TPCN02341

Name ;Rabdokunmin C
Molecular Formula C20H30O5
Molecular Weight 350.46
CAS Registry Number 126005-67-2
SMILES C=C1C(=O)C23C(O)CC4C(C)(CO)CCCC4(C)C2CC(O)C1C3O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon excisus Aerial parts 0.002367% J Nat Prod 67, 373-376 (2004). 10.1021/np030357r
Lamiaceae Isodon inflexus Aerial parts 0.000117% Nat Prod Res 30, 995-1000 (2016). 10.1080/14786419.2015.1094803
Properties
HBA 5 HBD 4
HeavyAtoms 25 AlogP 1.04
TPSA 97.99 RotatableBonds 1
FractionCSP3 0.85 Rings 4
AromaticRings 0 AliphaticRings 4