TPCN03856

Name Madlongisides B
Molecular Formula C41H64O15
Molecular Weight 796.95
CAS Registry Number 312959-41-4
SMILES CC1(C)CCC2(C(=O)OC3OCC(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(=O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5C(O)CC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapotaceae Madhuca longifolia Seeds 0.000455% J Nat Prod, 2000, 63, 1679-1681. 10.1021/np000351r
Properties
HBA 15 HBD 9
HeavyAtoms 56 AlogP 0.08
TPSA 253.13 RotatableBonds 6
FractionCSP3 0.90 Rings 7
AromaticRings 0 AliphaticRings 7