ACETOXOLONE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H48O5
Molecular Weight	512.7205
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACETOXOLONE

Structure Search

SMILES

[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]3(C)C2=CC(=O)[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)C(O)=O

InChI

InChIKey=FTQDJVZNPJRVPG-XWEVEMRCSA-N

InChI=1S/C32H48O5/c1-19(33)37-24-10-11-30(6)23(27(24,2)3)9-12-32(8)25(30)22(34)17-20-21-18-29(5,26(35)36)14-13-28(21,4)15-16-31(20,32)7/h17,21,23-25H,9-16,18H2,1-8H3,(H,35,36)/t21-,23-,24-,25+,28+,29-,30-,31+,32+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H48O5
Molecular Weight	512.7205
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:20:47 UTC 2023` Edited by `admin` on `Fri Dec 15 17:20:47 UTC 2023`
Record UNII	CWW961Q19K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACETOXOLONE

Common Name

English

URALENIC ACID, ACETATE

Common Name

English

Acetoxolone [WHO-DD]

Common Name

English

ACETYLGLYCYRRHETIC ACID

Common Name

English

DGS 0110A

Code

English

ACETOXOLONE [MI]

Common Name

English

GLYCYRRHETIC ACID ACETATE

Common Name

English

3-O-ACETYL-18.BETA.-GLYCYRRHETIC ACID

Common Name

English

NSC-35349

Code

English

GLYCYRRHETINIC ACID ACETATE

Common Name

English

GLYCYRRHETINYL ACETATE

Common Name

English

3.BETA.-HYDROXY-11-OXOOLEAN-12-EN-30-OIC ACID ACETATE

Common Name

English

OLEAN-12-EN-29-OIC ACID, 3-(ACETYLOXY)-11-OXO-, (3.BETA.,20.BETA.)-

Common Name

English

ACETYLGLYCYRRHETINIC ACID

Common Name

English

(3.BETA.,20.BETA.)-3-(ACETYLOXY)-11-OXOOLEAN-12-EN-29-OIC ACID

Common Name

English

DGS-0110A

Code

English

Classification Tree Code System Code

WHO-ATC

A02BX09

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

NCI_THESAURUS

C29701

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

WHO-VATC

QA02BX09

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

Code System Code Type Description

ECHA (EC/EINECS)

228-475-1

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

WIKIPEDIA

ACETOXOLONE

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

EPA CompTox

DTXSID801031583

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

RXCUI

16784

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

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RxNorm

MESH

C013384

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

DRUG CENTRAL

62

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

MERCK INDEX

m1344

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

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Merck Index

NSC

35349

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

ChEMBL

CHEMBL207413

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

DRUG BANK

DB13640

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

PUBCHEM

94320

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

NCI_THESAURUS

C98247

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

CAS

6277-14-1

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

FDA UNII

CWW961Q19K

Created by admin on Fri Dec 15 17:20:47 UTC 2023 , Edited by admin on Fri Dec 15 17:20:47 UTC 2023

PRIMARY

Related Record Type Details


					85RP28F39U

ACETOXOLONE ALUMINUM

SALT/SOLVATE -> PARENT

Related Record Type Details


					CWW961Q19K

ACTIVE MOIETY