TPCN05305

Name Adianthifoliosides A
Molecular Formula C79H121NO38
Molecular Weight 1692.81
CAS Registry Number 503552-35-0
SMILES CC(=O)NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)C(OC(=O)c6ccccc6O)CC5(C(=O)OC5OC(CO)C(O)C(O)C5OC5OC(C)C(OC6OC(CO)C(O)C6O)C(OC6OC(CO)C(O)C(O)C6O)C5O)C(O)CC34C)C2(C)C)OC(COC2OC(C)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Albizia adianthifolia Roots 0.006500% Bioorg Med Chem. 2004. 12, 4725-4734. 10.1016/j.bmc.2004.06.025.
Properties
HBA 39 HBD 21
HeavyAtoms 118 AlogP -5.57
TPSA 606.29 RotatableBonds 21
FractionCSP3 0.86 Rings 13
AromaticRings 1 AliphaticRings 12