TPCN02727

Name 7??-Hydroxysitosterol
Molecular Formula C29H50O2
Molecular Weight 430.72
CAS Registry Number 15140-59-7
SMILES CCC(CCC(C)C1CCC2C3C(O)C=C4CC(O)CCC4(C)C3CCC12C)C(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Ixora amplexicaulis Stems 0.000333% Nat Prod Res 30, 105-109 (2016). 10.1080/14786419.2015.1039000
Properties
HBA 2 HBD 2
HeavyAtoms 31 AlogP 7.00
TPSA 40.46 RotatableBonds 6
FractionCSP3 0.93 Rings 4
AromaticRings 0 AliphaticRings 4