TPCN04472

Name Leptocarposide
Molecular Formula C66H104O31
Molecular Weight 1393.53
CAS Registry Number 1569522-17-3
SMILES CC(O)CC(=O)OC(C)CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(C)CC3O)C(OC2OC(C)C(OC3OCC(O)C(O)C3O)C(O)C2O)C1OC1OCC(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Onagraceae Ludwigia leptocarpa Whole plants 0.000500% Magn Reson Chem 52(1-2): 32-36. 10.1002/mrc.4023
Properties
HBA 31 HBD 15
HeavyAtoms 97 AlogP -2.20
TPSA 482.49 RotatableBonds 18
FractionCSP3 0.91 Rings 10
AromaticRings 0 AliphaticRings 10