TPCN04490
Name | Albizoside B |
Molecular Formula | C124H196O61 |
Molecular Weight | 2662.87 |
CAS Registry Number | 1137673-13-2 |
SMILES | C=CC(C)(CCC=C(CO)C(=O)OC1C(OC(C)(C=C)CCC=C(C)C(=O)OC2C(C)OC(OC(C)(C=C)CCC=C(CO)C(=O)OC3CC4(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)CC5(C)C(=CCC6C7(C)CCC(OC8OC(COC9OC(C)C(O)C(O)C9OC9OCC(O)C(O)C9O)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(C)(C)C7CCC65C)C4CC3(C)C)C(O)C2O)OC(C)C(O)C1O)OC1OC(C)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Albizia chinensis | Barks | 0.000455% | J Nat Prod 72(4): 632-639. | 10.1021/np800576s |
Properties
HBA | 61 | HBD | 32 |
HeavyAtoms | 185 | AlogP | -8.32 |
TPSA | 946.39 | RotatableBonds | 47 |
FractionCSP3 | 0.85 | Rings | 16 |
AromaticRings | 0 | AliphaticRings | 16 |