U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C34H50O7
Molecular Weight 570.7566
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBENOXOLONE

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(=O)CCC(O)=O)C(C)(C)[C@]5([H])CC[C@@]34C)C(O)=O

InChI

InChIKey=OBZHEBDUNPOCJG-WBXJDKIVSA-N
InChI=1S/C34H50O7/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40)/t21-,23-,24-,27+,30+,31-,32-,33+,34+/m0/s1

HIDE SMILES / InChI
Molecular Formula C34H50O7
Molecular Weight 570.7566
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:53:07 UTC 2023
Edited
by admin
on Fri Dec 15 15:53:07 UTC 2023
Record UNII
MM6384NG73
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBENOXOLONE
INN   MI   WHO-DD  
INN  
Official Name English
OLEAN-12-EN-29-OIC ACID, 3-(3-CARBOXY-1-OXOPROPOXY)-11-OXO, (3.BETA.,20.BETA.)-
Common Name English
carbenoxolone [INN]
Common Name English
CARBENOXOLONE [MI]
Common Name English
Carbenoxolone [WHO-DD]
Common Name English
3.BETA.-HYDROXY-11-OXOOLEAN-12-EN-30-OIC ACID HYDROGEN SUCCINATE
Common Name English
Classification Tree Code System Code
WHO-VATC QA02BX71
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
NCI_THESAURUS C54678
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
FDA ORPHAN DRUG 429414
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
WHO-ATC A02BX71
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
WHO-VATC QA02BX01
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
WHO-ATC A02BX51
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
WHO-ATC A02BX01
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
Code System Code Type Description
DRUG CENTRAL
493
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
RXCUI
2017
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY RxNorm
FDA UNII
MM6384NG73
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
INN
1789
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
EVMPD
SUB06123MIG
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
ECHA (EC/EINECS)
227-174-2
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
DRUG BANK
DB02329
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
WIKIPEDIA
CARBENOXOLONE
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
MERCK INDEX
m3064
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY Merck Index
PUBCHEM
636403
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
ChEMBL
CHEMBL499915
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
NCI_THESAURUS
C63669
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
SMS_ID
100000081319
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID4022733
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
CAS
5697-56-3
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
MESH
D002229
Created by admin on Fri Dec 15 15:53:07 UTC 2023 , Edited by admin on Fri Dec 15 15:53:07 UTC 2023
PRIMARY
Related Record Type Details
11.BETA.-HYDROXYSTEROID DEHYDROGENASE TYPE 1
TARGET -> INHIBITOR
Structure of CARBENOXOLONE SODIUM
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of CARBENOXOLONE
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966