TPCN01699

Name Vermicularone
Molecular Formula C15H20O4
Molecular Weight 264.32
CAS Registry Number 869558-66-7
SMILES CC1=CC(=O)C2=C(C)CC(O)C3C(C)C(O)OC3C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Abelmoschus sagittifolius Whole plants 0.000187% Nat Prod Res 19, 551-559(2005) 10.1080/14786410410001715604
Properties
HBA 4 HBD 2
HeavyAtoms 19 AlogP 1.18
TPSA 66.76 RotatableBonds 0
FractionCSP3 0.67 Rings 3
AromaticRings 0 AliphaticRings 3