TPCN02255

Name 13-0-acetylvakhmatine
Molecular Formula C22H29NO5
Molecular Weight 387.48
CAS Registry Number 172045-40-8
SMILES C=C1CC23CC4C5C6(C)CC(O)CC57C(C2C(OC(C)=O)C1C(O)C37)N4C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Consolida ambigua Seeds 0.004500% J Nat Prod 58, 1527-1532 (1995). 10.1021/np50124a008
Properties
HBA 6 HBD 3
HeavyAtoms 28 AlogP 0.65
TPSA 90.23 RotatableBonds 1
FractionCSP3 0.86 Rings 9
AromaticRings 0 AliphaticRings 9