THIOCTATE TROMETAMOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C8H14O2S2.C4H11NO3
Molecular Weight	327.461
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(CO)(CO)CO.OC(=O)CCCCC1CCSS1

InChI

InChIKey=CCTREOMTIFSZAU-UHFFFAOYSA-N

InChI=1S/C8H14O2S2.C4H11NO3/c9-8(10)4-2-1-3-7-5-6-11-12-7;5-4(1-6,2-7)3-8/h7H,1-6H2,(H,9,10);6-8H,1-3,5H2

HIDE SMILES / InChI

Molecular Formula	C8H14O2S2
Molecular Weight	206.326
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	C4H11NO3
Molecular Weight	121.135
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.rxwiki.com/trometamol | http://www.tabletwise.com/medicine/trometamol | https://pubchem.ncbi.nlm.nih.gov/compound/tromethamine

Trometamol is an organic amine proton acceptor. It is used in the synthesis of surface-active agents and pharmaceuticals; as an emulsifying agent for cosmetic creams and lotions, mineral oil and paraffin wax emulsions, as a biological buffer, and used as an alkalizer.

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Acidosis 1 Sources: https://www.rxwiki.com/trometamol http://www.tabletwise.com/medicine/trometamol	Primary		Approved 8583	Unknown Approved Use Unknown

C_max

Value	Dose	Analyte	Population
71.78 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
42.74 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
302.98 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
182.23 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
429.28 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
231.27 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
473.74 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
235.08 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
1135.1 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
591.33 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
2654 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
1735 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FED
1415 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
1003 ng/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FED
14.8 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
14.4 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
19.1 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
17.4 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
19.8 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
21.1 nmol/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED

AUC

Value	Dose	Analyte	Population
110.23 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
65.51 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
261.73 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
147.89 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
506.77 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
282.67 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
752.76 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
393.69 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
1814.81 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
929.34 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
2518 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
1926 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FED
1361 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
1134 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/8858282/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FED
900.9 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
852.4 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
1061.7 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
910.1 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
894.4 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
998.7 μM × min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED

T_1/2

Value	Dose	Analyte	Population
0.5 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.56 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	50 mg single, oral dose: 50 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.5 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.47 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	100 mg single, oral dose: 100 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.67 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.69 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	200 mg single, oral dose: 200 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.58 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.6 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	300 mg single, oral dose: 300 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.6 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, ( )- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
0.64 h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/10072479/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID, (-)- plasma	Homo sapiens population: HEALTHY age: ADULT sex: MALE food status: FASTED
21.1 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
21.6 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
21.1 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
23.1 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg single, oral dose: 600 mg route of administration: Oral experiment type: SINGLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
32.2 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED
30.1 min EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/15703366/	600 mg 1 times / day multiple, oral dose: 600 mg route of administration: Oral experiment type: MULTIPLE co-administered:	THIOCTIC ACID plasma	Homo sapiens population: HEALTHY age: ADULT sex: FEMALE / MALE food status: FASTED

PubMed

Title	Date	PubMed
Sodium bicarbonate versus THAM in ICU patients with mild metabolic acidosis.	2005-07-14	16013019
The treatment of acidosis in acute lung injury with tris-hydroxymethyl aminomethane (THAM).	2000-04	10764304

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:08:39 GMT 2025` Edited by `admin` on `Mon Mar 31 22:08:39 GMT 2025`
Record UNII	V8276EBZ06
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THIOCTATE TROMETAMOL

Common Name

English

1,2-DITHIOLANE-3-VALERIC ACID, COMPD. WITH 2-AMINO-2-(HYDROXYMETHYL)-1,3-PROPANEDIOL (1:1)

Preferred Name

English

1,2-DITHIOLANE-3-PENTANOIC ACID, COMPD. WITH 2-AMINO-2-(HYDROXYMETHYL)-1,3-PROPANEDIOL (1:1)

Systematic Name

English

Thioctate trometamol [WHO-DD]

Common Name

English

1,3-PROPANEDIOL, 2-AMINO-2-(HYDROXYMETHYL)-, 1,2-DITHIOLANE-3-PENTANOATE (SALT)

Common Name

English

1,3-PROPANEDIOL, 2-AMINO-2-(HYDROXYMETHYL)-, 1,2-DITHIOLANE-3-VALERATE (SALT)

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

238-329-9