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Details

Stereochemistry ACHIRAL
Molecular Formula 2C18H30N2O2.H2O4S
Molecular Weight 710.964
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTACAINE SULFATE

SMILES

OS(O)(=O)=O.CCCCN(CCCC)CCCOC(=O)C1=CC=C(N)C=C1.CCCCN(CCCC)CCCOC(=O)C2=CC=C(N)C=C2

InChI

InChIKey=VWZAGCZUPZKTET-UHFFFAOYSA-N
InChI=1S/2C18H30N2O2.H2O4S/c2*1-3-5-12-20(13-6-4-2)14-7-15-22-18(21)16-8-10-17(19)11-9-16;1-5(2,3)4/h2*8-11H,3-7,12-15,19H2,1-2H3;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula C18H30N2O2
Molecular Weight 306.443
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Keratitis from misuse of corneal anesthetics.
1968 Aug 22
Selective dopaminergic vulnerability: 3,4-dihydroxyphenylacetaldehyde targets mitochondria.
2001 Apr 15
Managing patients with local anesthetic complications using alternative methods.
2002 May-Jun
PAMPA - excipient classification gradient map.
2006 Nov
Solubility-excipient classification gradient maps.
2007 Mar
Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
The specific activities of two transferases, aspartate-amino-transferase and creatine phosphokinase, are increased by 10(-5) mol/l butacaine
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:00:27 GMT 2023
Edited
by admin
on Fri Dec 15 15:00:27 GMT 2023
Record UNII
PAU39W3CVB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTACAINE SULFATE
GREEN BOOK   MART.   MI   USP-RS   WHO-DD  
Common Name English
BUTACAINE SULFATE [MART.]
Common Name English
BUTACAINE SULPHATE
Common Name English
BUTACAINE SULFATE [MI]
Common Name English
3-(DIBUTYLAMINO)-1-PROPANOL P-AMINOBENZOATE (ESTER) SULFATE (2:1)
Common Name English
1-PROPANOL, 3-(DIBUTYLAMINO)-, 4-AMINOBENZOATE (ESTER), SULPHATE (SALT) (2:1)
Common Name English
Butacaine sulfate [WHO-DD]
Common Name English
BUTACAINE SULFATE [GREEN BOOK]
Common Name English
1-PROPANOL, 3-(DIBUTYLAMINO)-, 4-AMINOBENZOATE (ESTER), SULFATE (SALT) (2:1)
Common Name English
3-(DIBUTYLAMINO)-1-PROPANOL P-AMINOBENZOATE (ESTER) SULPHATE (2:1)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C245
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL129529
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
DRUG BANK
DBSALT001668
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
RXCUI
133044
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY RxNorm
MERCK INDEX
m2780
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
205-733-1
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
NCI_THESAURUS
C77320
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID30164149
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
SMS_ID
100000084856
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
PUBCHEM
120185
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
EVMPD
SUB00907MIG
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
FDA UNII
PAU39W3CVB
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
CAS
149-15-5
Created by admin on Fri Dec 15 15:00:27 GMT 2023 , Edited by admin on Fri Dec 15 15:00:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY