N-OLEOYL TAURINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H39NO4S
Molecular Weight	389.593
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of N-OLEOYL TAURINE

Structure Search

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)NCCS(O)(=O)=O

InChI

InChIKey=KOGRJTUIKPMZEJ-KTKRTIGZSA-N

InChI=1S/C20H39NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)21-18-19-26(23,24)25/h9-10H,2-8,11-19H2,1H3,(H,21,22)(H,23,24,25)/b10-9-

HIDE SMILES / InChI

Molecular Formula	C20H39NO4S
Molecular Weight	389.593
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:43:54 GMT 2025` Edited by `admin` on `Mon Mar 31 22:43:54 GMT 2025`
Record UNII	F9Y8TQZ5HY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-OLEOYL TAURINE

Common Name

English

OLEOYLTAURINE

Preferred Name

English

2-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)ETHANESULFONIC ACID

Systematic Name

English

ETHANESULFONIC ACID, 2-((1-OXO-9-OCTADECENYL)AMINO)-, (Z)-

Systematic Name

English

TAURINE, N-OLEOYL-

Common Name

English

ETHANESULFONIC ACID, 2-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

257-985-7

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

PRIMARY

CHEBI

146206

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

PRIMARY

PUBCHEM

6437033

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

PRIMARY

EPA CompTox

DTXSID901196879

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

PRIMARY

CAS

52514-04-2

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

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FDA UNII

F9Y8TQZ5HY

Created by admin on Mon Mar 31 22:43:54 GMT 2025 , Edited by admin on Mon Mar 31 22:43:54 GMT 2025

PRIMARY

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