(3α,5β,7α,12α)-Cholane-3,7,12,24-tetrol
CAS Registry Number®
3758-71-2
CAS Name
(3α,5β,7α,12α)-Cholane-3,7,12,24-tetrolMolecular Formula
C24H42O4Molecular Mass
394.59Cite this Page
(3α,5β,7α,12α)-Cholane-3,7,12,24-tetrol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3758-71-2 (retrieved ) (CAS RN: 3758-71-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
238-239 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C24H42O4/c1-14(5-4-10-25)17-6-7-18-22-19(13-21(28)24(17,18)3)23(2)9-8-16(26)11-15(23)12-20(22)27/h14-22,25-28H,4-13H2,1-3H3/t14-,15+,16-,17-,18+,19+,20-,21+,22+,23+,24-/m1/s1
InChIKey
InChIKey=BMSROUVLRAQRBY-YHEMGIGTSA-N
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)([C@@H](O)C3)[C@@]([C@@H](CCCO)C)(CC4)[H])[H])([C@H](O)C[C@@]1(C[C@H](O)CC2)[H])[H])[H]
Canonical SMILES
OCCCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C
Other Names for this Substance
- Cholane-3,7,12,24-tetrol, (3α,5β,7α,12α)-
- 5β-Cholane-3α,7α,12α,24-tetrol
- (3α,5β,7α,12α)-Cholane-3,7,12,24-tetrol
- Cholyl alcohol
- 5β-Petromyzonol
Deleted or Replaced CAS Registry Numbers
80114-76-7