Dihydrobrassicasterol
CAS Registry Number®
4651-51-8
CAS Name
DihydrobrassicasterolMolecular Formula
C28H48OMolecular Mass
400.68Cite this Page
Dihydrobrassicasterol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=4651-51-8 (retrieved ) (CAS RN: 4651-51-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
157-158 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1
InChIKey
InChIKey=SGNBVLSWZMBQTH-ZRUUVFCLSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(=CC3)C[C@@H](O)CC4)(CC1)[H])[H])(CC[C@@]2([C@@H](CC[C@@H](C(C)C)C)C)[H])[H]
Canonical SMILES
OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(C)C(C)C)C2(C)CC1
Other Names for this Substance
- Ergost-5-en-3-ol, (3β)-
- Ergost-5-en-3β-ol
- (3β)-Ergost-5-en-3-ol
- Δ5-Ergostenol
- Δ22-Dihydrobrassicasterol
Deleted or Replaced CAS Registry Numbers
14270-66-7, 15764-39-3, 136897-23-9, 1253203-44-9