TPCN05040

Name Caryocarosides III-16
Molecular Formula C65H106O34
Molecular Weight 1431.53
CAS Registry Number 905448-51-3
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)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 0.001011% J Nat Prod 69, 919-926 (2006) 10.1021/np060097o
Properties
HBA 34 HBD 21
HeavyAtoms 99 AlogP -7.80
TPSA 552.66 RotatableBonds 18
FractionCSP3 0.95 Rings 11
AromaticRings 0 AliphaticRings 11