TPCN04009

Name Parvilobaside A
Molecular Formula C48H76O17
Molecular Weight 925.12
CAS Registry Number 1202014-39-8
SMILES CC(=O)OCC1(C)C(OC2OCC(O)C(O)C2OC2OC(C)C(O)C(OC3OCC(O)C(O)C3O)C2O)CCC2(C)C1CCC1(C)C2CC=C2C3CC(C)(C)CCC3(C(=O)O)CCC21C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis parviloba Stems 0.000158% J Asian Nat Prod Res, 2009, 11, 332-338. 10.1080/10286020902727348
Properties
HBA 17 HBD 8
HeavyAtoms 65 AlogP 2.56
TPSA 260.59 RotatableBonds 9
FractionCSP3 0.92 Rings 8
AromaticRings 0 AliphaticRings 8