TPCN04475

Name 24-methylenecycloartanol transferulate
Molecular Formula C41H60O4
Molecular Weight 616.93
CAS Registry Number 286011-28-7
SMILES C=C(CCC(C)C1CCC2(C)C3CCC4C(C)(C)C(OC(=O)C=Cc5ccc(O)c(OC)c5)CCC45CC35CCC12C)C(C)C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapindaceae Oryza sativa Peels 0.000500% J Nat Prod 68(1): 94-97. 10.1021/np049889d
Properties
HBA 4 HBD 1
HeavyAtoms 45 AlogP 10.39
TPSA 55.76 RotatableBonds 9
FractionCSP3 0.73 Rings 6
AromaticRings 1 AliphaticRings 5