Androstane-3,17-diol, monohydrate, (3β,5α,17β)-
CAS Registry Number®
42366-37-0
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CAS Name
Androstane-3,17-diol, monohydrate, (3β,5α,17β)-Molecular Formula
C19H32O2.H2OCite this Page
Androstane-3,17-diol, monohydrate, (3β,5α,17β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=42366-37-0 (retrieved ) (CAS RN: 42366-37-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C19H32O2.H2O/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18;/h12-17,20-21H,3-11H2,1-2H3;1H2/t12-,13-,14-,15-,16-,17-,18-,19-;/m0./s1
InChIKey
InChIKey=IOIXDBPGNHNGOY-JXZLFAAWSA-N
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](O)CC4)[H])(CC[C@]1(C[C@@H](O)CC2)[H])[H])[H].O
Canonical SMILES
O.OC1CCC2(C)C(CCC3C4CCC(O)C4(C)CCC32)C1
Other Names for this Substance
- Androstane-3,17-diol, monohydrate, (3β,5α,17β)-
- 3β,17β-Dihydroxy-5α-androstane monohydrate
