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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H39O4.Na
Molecular Weight 414.5538
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM DESOXYCHOLATE

SMILES

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

InChI

InChIKey=FHHPUSMSKHSNKW-SMOYURAASA-M
InChI=1S/C24H40O4.Na/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3;/h14-21,25-26H,4-13H2,1-3H3,(H,27,28);/q;+1/p-1/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SODIUM DESOXYCHOLATE
II  
Common Name English
ATX-101 (SODIUM DESOXYCHOLATE)
Code English
SODIUM DEOXYCHOLIC ACID
Common Name English
NSC-681065
Code English
3-.ALPHA.,12-.ALPHA.-DIHYDROXY-5-.BETA.-CHOLAN-24-OIC ACID SODIUM SALT
Common Name English
SODIUM DEOXYCHOLATE [INCI]
Common Name English
DEOXYCHOLIC ACID, SODIUM SALT
Common Name English
SODIUM DESOXYCHOLATE [II]
Common Name English
SODIUM DEOXYCHOLATE
INCI  
INCI  
Official Name English
KYBELLA
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C843
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
Code System Code Type Description
DRUG BANK
DB05780
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
CHEBI
9177
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
SMS_ID
100000076463
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
CAS
302-95-4
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID5033389
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
EVMPD
SUB15971MIG
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
FDA UNII
436LS6U35Y
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
NCI_THESAURUS
C80912
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
WIKIPEDIA
Sodium deoxycholate
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
ECHA (EC/EINECS)
206-132-7
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
NSC
681065
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
DAILYMED
436LS6U35Y
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY
PUBCHEM
23668196
Created by admin on Fri Dec 15 16:18:32 UTC 2023 , Edited by admin on Fri Dec 15 16:18:32 UTC 2023
PRIMARY