TPCN01001

Name Cacalol
Molecular Formula C15H18O2
Molecular Weight 230.31
CAS Registry Number 24393-79-1
SMILES Cc1coc2c(O)c3c(c(C)c12)C(C)CCC3
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Japonicalia delphiniifolia Whole plants 0.004280% Biosci Biotechnol Biochem 68(6): 1393-1394.(2004) 10.1271/bbb.68.1393
Properties
HBA 2 HBD 1
HeavyAtoms 17 AlogP 4.20
TPSA 33.37 RotatableBonds 0
FractionCSP3 0.47 Rings 3
AromaticRings 2 AliphaticRings 1