TPCN01358

Name Lactucopicrin
Molecular Formula C23H22O7
Molecular Weight 410.42
CAS Registry Number 65725-11-3
SMILES C=C1C(=O)OC2C3C(CO)=CC(=O)C3=C(C)CC(OC(=O)Cc3ccc(O)cc3)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Cichorium endivia Roots 0.000635% Chem Pharm Bull (Tokyo) 36(7): 2423-2429.(1988) 10.1248/cpb.36.2423
Properties
HBA 7 HBD 2
HeavyAtoms 30 AlogP 1.78
TPSA 110.13 RotatableBonds 4
FractionCSP3 0.35 Rings 4
AromaticRings 1 AliphaticRings 3