TAUROURSODEOXYCHOLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H45NO6S
Molecular Weight	499.704
Optical Activity	( + )
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H](CCC(=O)NCCS(O)(=O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=BHTRKEVKTKCXOH-LBSADWJPSA-N

InChI=1S/C26H45NO6S/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H45NO6S
Molecular Weight	499.704
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Mar 06 11:17:25 UTC 2018` Edited by `admin` on `Tue Mar 06 11:17:25 UTC 2018`
Record UNII	60EUX8MN5X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TAUROURSODEOXYCHOLIC ACID

Common Name

English

TAUROURSODESOXYCHOLIC ACID [WHO-DD]

Common Name

English

TAUROURSODESOXYCHOLIC ACID

Common Name

English

UR-906

Common Name

English

3.ALPHA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLANOYLTAURINE

Common Name

English

URSODEOXYCHOLYLTAURINE

Common Name

English

Code System Code Type Description

PUBCHEM

9848818