TPCN04455

Name Sasanquasaponin V
Molecular Formula C59H96O25
Molecular Weight 1205.39
CAS Registry Number 1352170-45-6
SMILES CCC(C)C(=O)OC1CC2(C)C(=CCC3C4(C)CCC(OC5OC(C(=O)O)C(O)C(OC6OC(CO)C(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC32C)C2CC(C)(C)CC(O)C12CO
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Theaceae Camellia sasanqua Buds 0.000575% Chem Pharm Bull (Tokyo) 58(12): 1617-1621. 10.1248/cpb.58.1617
Properties
HBA 25 HBD 14
HeavyAtoms 84 AlogP -0.90
TPSA 400.43 RotatableBonds 15
FractionCSP3 0.93 Rings 9
AromaticRings 0 AliphaticRings 9