TPCN05058
Name | Caryocaroside III-15 |
Molecular Formula | C59H96O29 |
Molecular Weight | 1269.39 |
CAS Registry Number | 905448-52-4 |
SMILES | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(OC7OC(COC8OC(CO)C(O)C(OC9OC(CO)C(O)C(OC%10OCC(O)C(O)C%10O)C9O)C8O)C(O)C(O)C7O)C6O)C(C)(CO)C5CCC43C)C2C1 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Caryocaraceae | Caryocar villosum | Fruits | 0.000787% | J Nat Prod 69, 919-926 (2006) | 10.1021/np060097o |
Properties
HBA | 29 | HBD | 18 |
HeavyAtoms | 88 | AlogP | -5.06 |
TPSA | 473.51 | RotatableBonds | 16 |
FractionCSP3 | 0.95 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |