TERBUTALINE TRI-O-SULFATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H19NO12S3
Molecular Weight	465.474
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)NCC(OS(O)(=O)=O)C1=CC(OS(O)(=O)=O)=CC(OS(O)(=O)=O)=C1

InChI

InChIKey=GIEHXBUAIYADEO-UHFFFAOYSA-N

InChI=1S/C12H19NO12S3/c1-12(2,3)13-7-11(25-28(20,21)22)8-4-9(23-26(14,15)16)6-10(5-8)24-27(17,18)19/h4-6,11,13H,7H2,1-3H3,(H,14,15,16)(H,17,18,19)(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula	C12H19NO12S3
Molecular Weight	465.474
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:58:58 UTC 2023` Edited by `admin` on `Sat Dec 16 08:58:58 UTC 2023`
Record UNII	LUE52L2793
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TERBUTALINE TRI-O-SULFATE

Common Name

English

1,3-BENZENEDIOL, 5-(2-((1,1-DIMETHYLETHYL)AMINO)-1-(SULFOOXY)ETHYL)-, 1,3-BIS(HYDROGEN SULFATE)

Systematic Name

English

Code System Code Type Description

PUBCHEM

91810667

Created by admin on Sat Dec 16 08:58:58 UTC 2023 , Edited by admin on Sat Dec 16 08:58:58 UTC 2023

PRIMARY

FDA UNII

LUE52L2793

Created by admin on Sat Dec 16 08:58:58 UTC 2023 , Edited by admin on Sat Dec 16 08:58:58 UTC 2023

PRIMARY

CAS

1273567-82-0

Created by admin on Sat Dec 16 08:58:58 UTC 2023 , Edited by admin on Sat Dec 16 08:58:58 UTC 2023

PRIMARY

Related Record Type Details


					N8ONU3L3PG

TERBUTALINE

PARENT -> METABOLITE

Interaction Type:

MAJOR

Qualification:

URINE