TPCN00757

Name Ervatamines A
Molecular Formula C21H24N2O4
Molecular Weight 368.43
CAS Registry Number 1787259-42-0
SMILES COC(=O)C12CC3CC(C(C)O)C1N(Cc1c2n(C=O)c2ccccc12)C3
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Ervatamia hainanensis Aerial parts 0.000022% J Nat Prod, 2015, 78, 1253-1261. 10.1021/acs.jnatprod.5b00051
Properties
HBA 6 HBD 1
HeavyAtoms 27 AlogP 1.70
TPSA 71.77 RotatableBonds 3
FractionCSP3 0.52 Rings 6
AromaticRings 2 AliphaticRings 4