TPCN01486

Name ;??-spinasterol 3-O-J3-D-glucopyranoside
Molecular Formula C35H58O6
Molecular Weight 574.84
CAS Registry Number 1745-36-4
SMILES CCC(C=CC(C)C1CCC2C3=CCC4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC21C)C(C)C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Myrsinaceae Ardisia mamillata Roots 0.000776% Phytochemistry . 2000 Aug;54(8):817-22 10.1016/s0031-9422(00)00173-4
Asteraceae Aster oharai Aerial parts 0.000400% Arch Pharm Res 26(7): 521-525.(2003) 10.1007/bf02976874
Properties
HBA 6 HBD 4
HeavyAtoms 41 AlogP 5.63
TPSA 99.38 RotatableBonds 8
FractionCSP3 0.89 Rings 5
AromaticRings 0 AliphaticRings 5