TPCN06023
Name | Maejaposide A |
Molecular Formula | C65H104O30 |
Molecular Weight | 1365.52 |
CAS Registry Number | 221467-02-3 |
SMILES | CCCC=CC(=O)OC1CC(C)(C)CC2C13C(O)CC1(C)C4(C)CCC5C(C)(C)C(OC6OC(C(=O)O)C(O)C(OC7OC(CO)C(O)C(O)C7OC7OC(C)C(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)CCC5(C)C4CCC21OC3O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Primulaceae | Maesa japonica | Roots | 0.002695% | J Nat Prod . 1999 Feb;62(2):228-32 | 10.1021/np980235c |
Properties
HBA | 30 | HBD | 16 |
HeavyAtoms | 95 | AlogP | -2.57 |
TPSA | 468.58 | RotatableBonds | 17 |
FractionCSP3 | 0.94 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |