TPCN00611

Name Rauvomines A
Molecular Formula C18H19ClN2O
Molecular Weight 314.82
CAS Registry Number 2126790-70-1
SMILES CC1C(Cl)C2CC3c4[nH]c5ccccc5c4CC(C2C=O)N31
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Rauvolfia vomitoria Aerial parts 0.000100% Org Lett, 2017, 19, 3998-4001. 10.1021/acs.orglett.7b01723
Properties
HBA 3 HBD 1
HeavyAtoms 22 AlogP 3.28
TPSA 36.10 RotatableBonds 1
FractionCSP3 0.50 Rings 6
AromaticRings 2 AliphaticRings 4