TPCN04747

Name Kadcoccinic acid G
Molecular Formula C30H46O5
Molecular Weight 486.69
CAS Registry Number 1802768-42-8
SMILES C=C1C(C(C)CCC=C(C)C(=O)O)CCC2(C)C1C=C1C2CCC(C(C)(C)O)C1(C)CCC(=O)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Schisandraceae Kadsura coccinea Stems 0.000060% 10.1021/acs.jnatprod.5b00392 10.1248/cpb.54.1380
Properties
HBA 5 HBD 3
HeavyAtoms 35 AlogP 6.63
TPSA 94.83 RotatableBonds 9
FractionCSP3 0.73 Rings 3
AromaticRings 0 AliphaticRings 3