TPCN02214

Name Glaucocalyxin B
Molecular Formula C22H30O5
Molecular Weight 374.48
CAS Registry Number 80508-81-2
SMILES C=C1C(=O)C23C(O)CC4C(C)(C)C(=O)CCC4(C)C2CCC1C3OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon japonica Leaves 0.007000% Acta Crystallogr Sect E Struct Rep Online 65, o1898 (2009). 10.1107/S1600536809027159
Properties
HBA 5 HBD 1
HeavyAtoms 27 AlogP 2.85
TPSA 80.67 RotatableBonds 1
FractionCSP3 0.77 Rings 4
AromaticRings 0 AliphaticRings 4