TPCN05135

Name Compound 7
Molecular Formula C48H76O20
Molecular Weight 973.12
CAS Registry Number 178249-00-8
SMILES COC(=O)C1OC(OC2C(O)CC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C)C2(C)CO)C(O)C(O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sabiaceae Meliosma lanceolata Barks 0.000294% Phytochemistry 42, 809-814 (1996) 10.1016/0031-9422(96)00003-9
Properties
HBA 20 HBD 11
HeavyAtoms 68 AlogP -1.10
TPSA 321.28 RotatableBonds 9
FractionCSP3 0.92 Rings 8
AromaticRings 0 AliphaticRings 8