TPCN00663

Name Ervatamines H
Molecular Formula C21H26N2O4
Molecular Weight 370.45
CAS Registry Number 1787259-56-6
SMILES COC(=O)C12CC3CN(CCc4c1[nH]c1ccccc41)C2C(C(C)O)C3O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Ervatamia hainanensis Aerial parts 0.000064% J Nat Prod, 2015, 78, 1253-1261. 10.1021/acs.jnatprod.5b00051
Properties
HBA 6 HBD 3
HeavyAtoms 27 AlogP 1.20
TPSA 85.79 RotatableBonds 2
FractionCSP3 0.57 Rings 6
AromaticRings 2 AliphaticRings 4