TPCN05708

Name Amphipaniculosides D
Molecular Formula C53H86O21
Molecular Weight 1059.25
CAS Registry Number 1695562-40-3
SMILES CC(C)=CCCC(C)C1C(OC2OCC(O)C(O)C2O)CC2(C)C3CCC4C(C)(C(=O)OC5OC(C)C(O)C(O)C5O)C(OC5OC(C)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)CCC45CC35CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Bignoniaceae Amphilophium paniculatum Leaves 0.003839% Phytochemistry. 2015 Jul;115:261-8. 10.1016/j.phytochem.2015.02.020.
Properties
HBA 21 HBD 12
HeavyAtoms 74 AlogP -0.37
TPSA 333.67 RotatableBonds 13
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9