TPCN03259

Name Tricalysiamide D
Molecular Formula C20H31NO4
Molecular Weight 349.47
CAS Registry Number 938050-32-9
SMILES CC12CCC3(O)NC(=O)CC3C1CCC13CC(CCC12)C(O)(CO)C3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Tricalysia dubia Woods 0.000008% J Nat Prod 70, 758-762 (2007). 10.1021/np0680681
Properties
HBA 5 HBD 4
HeavyAtoms 25 AlogP 1.55
TPSA 89.79 RotatableBonds 1
FractionCSP3 0.95 Rings 5
AromaticRings 0 AliphaticRings 5