TPCN05064
Name | Caryocaroside II-24 |
Molecular Formula | C61H90O28 |
Molecular Weight | 1271.36 |
CAS Registry Number | 914257-96-8 |
SMILES | CC1OC(OC2C(O)C(CO)OC(OC3C(O)C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CCC7(C(=O)OC7OC(CO)C(O)C(O)C7OC(=O)c7cc(O)c(O)c(O)c7)CCC56C)C4(C)CO)OC(C(=O)O)C3O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Caryocaraceae | Caryocar villosum | Barks | 0.000750% | Phytochemistry 67, 2096-2102 (2006) | 10.1016/j.phytochem.2006.07.009 |
Properties
HBA | 28 | HBD | 16 |
HeavyAtoms | 89 | AlogP | -0.96 |
TPSA | 457.96 | RotatableBonds | 14 |
FractionCSP3 | 0.82 | Rings | 10 |
AromaticRings | 1 | AliphaticRings | 9 |