TPCN01146

Name ??-sitosterol;B-sitosterol;Sitosterol;(-)-??-Sitosterol
Molecular Formula C29H50O
Molecular Weight 414.72
CAS Registry Number 83-46-5
SMILES CCC(CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(C)C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ligularia intermedia Roots 0.033333% Planta Med 63(6): 573-574. 10.1055/s-2006-957773
Oleaceae Olea europaea Leaves 0.004150% Chem Pharm Bull (Tokyo). 2007 May;55(5):784-8. 10.1248/cpb.55.784.
Verbenaceae Lantana montevidensis Leaves 0.004000% Nat Prod Res 27(21): 2046-2052. 10.1080/14786419.2013.824443
Lamiaceae Salvia syriaca Roots 0.003649% Planta Medica 66 (2000) 627±629 10.1055/s-2000-8629
Asteraceae Ligularia odontomanes Whole plants 0.002813% Chem Pharm Bull (Tokyo). 2007. 55, 577-579. 10.1248/cpb.55.577
Asteraceae Tanacetum gracile Whole plants 0.001789% Nat Prod Res 30, 2291-2298(2016) 10.1080/14786419.2016.1164701
Lamiaceae Teucrium viscidum Whole plants 0.000080% Molecules. 2013. 18, 1262-1269. 10.3390/molecules18011262.
Properties
HBA 1 HBD 1
HeavyAtoms 30 AlogP 8.02
TPSA 20.23 RotatableBonds 6
FractionCSP3 0.93 Rings 4
AromaticRings 0 AliphaticRings 4