TPCN04299

Name Clematiunicinoside G
Molecular Formula C88H144O48
Molecular Weight 1970.07
CAS Registry Number 1699748-23-6
SMILES CC1OC(OCC2OC(OC3C(CO)OC(OC4COC(OC5C(O)C(C)OC(OC6C(OC7CCC8(C)C(CCC9(C)C8CC=C8C%10CC(C)(C)CCC%10(C(=O)OC%10OC(COC%11OC(CO)C(OC%12OC(C)C(O)C(O)C%12O)C(O)C%11O)C(O)C(O)C%10O)CCC89C)C7(C)C)OCC(O)C6O)C5O)C(O)C4O)C(O)C3O)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis uncinata Roots 0.002000% Chem Pharm Bull (Tokyo) 62(1): 35-44. 10.1248/cpb.c13-00269
Properties
HBA 48 HBD 27
HeavyAtoms 136 AlogP -10.73
TPSA 747.88 RotatableBonds 25
FractionCSP3 0.97 Rings 15
AromaticRings 0 AliphaticRings 15