TPCN03645

Name Silphioside B
Molecular Formula C42H68O13
Molecular Weight 780.99
CAS Registry Number 78454-20-3
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Calendula stellata Whole plants 0.002678% Phytochemistry 144: 33-42. 10.1016/j.phytochem.2017.08.015
Ranunculaceae Souliea vaginata Whole plants 0.001440% Chem Pharm Bull (Tokyo) 52, 622-624 (2004). 10.1248/cpb.52.622
Ranunculaceae Anemone flaccida Subterraneous stems 0.000269% J Asian Nat Prod Res . 2014;16(9):910-21 10.1080/10286020.2014.954554
Properties
HBA 13 HBD 8
HeavyAtoms 55 AlogP 2.32
TPSA 215.83 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7