TPCN04788

Name Steganogenin 3-O-??-D-glucopyranoside
Molecular Formula C36H58O9
Molecular Weight 634.85
CAS Registry Number 2170742-67-1
SMILES CC(C)(CCO)CC1C(C(=O)O)=CCC2(C)C1=CCC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Hydrocotyle nepalensis Whole plants 0.000020% Fitoterapia 110: 66-71. 10.1016/j.fitote.2016.02.003
Properties
HBA 9 HBD 6
HeavyAtoms 45 AlogP 4.20
TPSA 156.91 RotatableBonds 8
FractionCSP3 0.86 Rings 5
AromaticRings 0 AliphaticRings 5