BARDOXOLONE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H41NO4
Molecular Weight	491.6615
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BARDOXOLONE

Structure Search

SMILES

[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]3(C)[C@]2([H])C(=O)C=C4[C@@]5(C)C=C(C#N)C(=O)C(C)(C)[C@]5([H])CC[C@@]34C)C(O)=O

InChI

InChIKey=TXGZJQLMVSIZEI-UQMAOPSPSA-N

InChI=1S/C31H41NO4/c1-26(2)10-12-31(25(35)36)13-11-30(7)23(19(31)16-26)20(33)14-22-28(5)15-18(17-32)24(34)27(3,4)21(28)8-9-29(22,30)6/h14-15,19,21,23H,8-13,16H2,1-7H3,(H,35,36)/t19-,21-,23-,28-,29+,30+,31-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

BARDOXOLONE

Official Name

English

bardoxolone [INN]

Common Name

English

2-Cyano-3,12-dioxooleana-1,9(11)-dien-28-oic acid

Systematic Name

English

RTA401

Code

English

CDDO

Code

English

OLEANA-1,9(11)-DIEN-28-OIC ACID, 2-CYANO-3,12-DIOXO-

Common Name

English

BARDOXOLONE [MI]

Common Name

English

RTA-401

Code

English

Bardoxolone [WHO-DD]

Common Name

English

(+)-2-CYANO-3,12-DIOXOOLEANA-1,9(11)-DIEN-28-OIC ACID

Common Name

English

BARDOXOLONE [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1323

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

NCI_THESAURUS

C29574

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

FDA ORPHAN DRUG

456114

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

FDA ORPHAN DRUG

264108

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

Code System Code Type Description

FDA UNII

7HT68L8941

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

PRIMARY

USAN

UU-156

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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DRUG BANK

DB12651

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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EPA CompTox

DTXSID001025273

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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NSC

711193

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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SMS_ID

300000000141

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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NCI_THESAURUS

C48382

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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INN

9108

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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CAS

218600-44-3

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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ChEMBL

CHEMBL1093059

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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MERCK INDEX

m2229

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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Merck Index

PUBCHEM

400010

Created by admin on Fri Dec 15 16:05:04 UTC 2023 , Edited by admin on Fri Dec 15 16:05:04 UTC 2023

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ACTIVE MOIETY


					7HT68L8941