TPCN04262

Name Huzhangoside C
Molecular Formula C64H104O29
Molecular Weight 1337.51
CAS Registry Number 96315-52-5
SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis uncinata Roots 0.003250% Chem Pharm Bull (Tokyo) 62(1): 35-44. 10.1248/cpb.c13-00269
Properties
HBA 29 HBD 16
HeavyAtoms 93 AlogP -3.05
TPSA 451.51 RotatableBonds 14
FractionCSP3 0.95 Rings 11
AromaticRings 0 AliphaticRings 11