TPCN05611

Name Platycoside J
Molecular Formula C52H84O23
Molecular Weight 1077.22
CAS Registry Number 899447-62-2
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C3(C)CC4O)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Campanulaceae Platycodon grandiflorum Roots 0.000082% Molecules. 2011. 16, 4371-4378. 10.3390/molecules16064371
Campanulaceae Platycodon grandiflorum Roots 0.000082% Chem Pharm Bull (Tokyo). 2006. 54, 557-560. 10.1248/cpb.54.557.
Properties
HBA 23 HBD 14
HeavyAtoms 75 AlogP -2.82
TPSA 374.13 RotatableBonds 10
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9