OBETICHOLIC ACID

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H44O4
Molecular Weight	420.6252
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OBETICHOLIC ACID

Structure Search

SMILES

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

InChI

InChIKey=ZXERDUOLZKYMJM-ZWECCWDJSA-N

InChI=1S/C26H44O4/c1-5-17-21-14-16(27)10-12-26(21,4)20-11-13-25(3)18(15(2)6-9-22(28)29)7-8-19(25)23(20)24(17)30/h15-21,23-24,27,30H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17-,18-,19+,20+,21+,23+,24-,25-,26-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

OBETICHOLIC ACID

Official Name

English

Obeticholic acid [WHO-DD]

Common Name

English

(3.ALPHA.,5.BETA.,6.ALPHA.,7.ALPHA.)-6-ETHYL-3,7-DIHYDROXYCHOLAN-24-OIC ACID

Common Name

English

obeticholic acid [INN]

Common Name

English

DSP-1747

Code

English

OCALIVA

Common Name

English

INT-747

Code

English

6-ETHYLCHENODEOXYCHOLIC ACID

Common Name

English

OBETICHOLIC ACID [JAN]

Common Name

English

OBETICHOLIC ACID [MI]

Common Name

English

6-ECDCA

Common Name

English

CHOLAN-24-OIC ACID, 6-ETHYL-3,7-DIHYDROXY-, (3.ALPHA.,5.BETA.,6.ALPHA.,7.ALPHA.)-

Common Name

English

OBETICHOLIC ACID [USAN]

Common Name

English

OBETICHOLIC ACID [ORANGE BOOK]

Common Name

English

6-ALPHA-ETHYLCHENODEOXYCHOLIC ACID

Common Name

English

Classification Tree Code System Code

NDF-RT

N0000192561

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

NCI_THESAURUS

C1636

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

EU-Orphan Drug

EU/3/10/753

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

FDA ORPHAN DRUG

253207

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

FDA ORPHAN DRUG

259008

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

WHO-ATC

A05AA04

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

FDA ORPHAN DRUG

937523

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

Code System Code Type Description

CHEBI

43602

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

EPA CompTox

DTXSID20196671

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

DRUG CENTRAL

5155

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

RXCUI

1798288

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

MERCK INDEX

m11955

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

DRUG BANK

DB05990

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

FDA UNII

0462Z4S4OZ

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

NCI_THESAURUS

C80837

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

CAS

459789-99-2

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

WIKIPEDIA

Obeticholic acid

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

INN

9084

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

EVMPD

SUB91981

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

ChEMBL

CHEMBL566315

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

NDF-RT

N0000192560

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

Farnesoid X Receptor Agonists [MoA]

SMS_ID

100000141528

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

USAN

TT-137

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

DAILYMED

0462Z4S4OZ

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

PUBCHEM

447715

Created by admin on Fri Dec 15 17:18:31 UTC 2023 , Edited by admin on Fri Dec 15 17:18:31 UTC 2023

PRIMARY

ACTIVE MOIETY


					0462Z4S4OZ

OBETICHOLIC ACID

METABOLITE (PARENT)


					MX5RXA86QQ

OBETICHOLIC ACID 3-GLUCURONIDE

METABOLITE (PARENT)


					Y62YER47AU

OBETICHOLIC ACID 24-GLUCURONIDE

METABOLITE ACTIVE (PARENT)


					T5IG4XE90K

TAURO-OBETICHOLIC ACID

METABOLITE ACTIVE (PARENT)


					O2MZK6V9LQ

GLYCO-OBETICHOLIC ACID