CAS Registry Number®
81-23-2
CAS Name
3,7,12-Triketo-5β-cholanoic acid
Molecular Formula
C24H34O5
Molecular Mass
402.52
Compound Properties
-
Melting Point (1)
237 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)
InChIKey
InChIKey=OHXPGWPVLFPUSM-UHFFFAOYSA-N
SMILES
O=C1C2C3C(C)(C(C(CCC(O)=O)C)CC3)C(=O)CC2C4(C)C(C1)CC(=O)CC4
Canonical SMILES
O=C(O)CCC(C)C1CCC2C3C(=O)CC4CC(=O)CCC4(C)C3CC(=O)C12C
Other Names for this Substance
- Cholan-24-oic acid, 3,7,12-trioxo-, (5β)-
- 5β-Cholan-24-oic acid, 3,7,12-trioxo-
- (5β)-3,7,12-Trioxocholan-24-oic acid
- Acolen
- Bilidren
- Bilostat
- Cholagon
- Cholic acid, dehydro-
- Chologon
- Dehychol
- Dehydrocholic acid
- Deidrocolico Vita
- Didrocolo
- Decholin
- Erebile
- Felacrinos
- Hykolex
- Ketocholanic acid
- Oxycholin
- Procholon
- Triketocholanic acid
- 3,7,12-Triketo-5β-cholanic acid
- 3,7,12-Triketocholanic acid
- 3,7,12-Triketo-5β-cholanoic acid
- 3,7,12-Trioxo-5β-cholanic acid
- 3,7,12-Trioxocholanic acid
- Dilabil
- DHC
- Cholimed
- Dehycon
- Didocol
- Dehystolin
- Sanocholen
- Drenobyl
- Novocolin
- 3,7,12-Trioxo-5β-cholan-24-oic acid
- Hydrochol
- 3,7,12-Tri-keto-5β-Cholan-24-oic acid
- Cholepatin
- Cholan DH
- NSC 8796
- MeSH ID: D003685
Deleted or Replaced CAS Registry Numbers
2604493-84-5, 2844461-58-9
