TPCN02663

Name 15-oxozoapatlin-13alpha-yl-10'alpha,16'alpha-dihydroxy-9'alpha-methyl-20'-nor-kau ran-19'-oic acid gamma-lactone-17'-oate
Molecular Formula C40H52O8
Molecular Weight 660.85
CAS Registry Number 912807-62-6
SMILES C=C1C(=O)C23CCC4C5(C)CCCC4(OC5=O)C2(C)CCC1(OC(=O)C1(O)CC24CCC5C6(C)CCCC5(OC6=O)C2(C)CCC1C4)C3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Chrysobalanaceae Parinari campestris Leaves 0.000426% Fitoterapia 76, 614-619 (2005). 10.1016/j.fitote.2005.05.005
Properties
HBA 8 HBD 1
HeavyAtoms 48 AlogP 6.30
TPSA 116.20 RotatableBonds 2
FractionCSP3 0.85 Rings 10
AromaticRings 0 AliphaticRings 10