TPCN01684

Name Sonchuside C
Molecular Formula C21H32O8
Molecular Weight 412.48
CAS Registry Number 111618-84-9
SMILES CC1=C2C3OC(=O)C(C)C3CCC2(C)CCC1OC1OC(CO)C(O)C(O)C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Cichorium intybus Roots 0.000200% Chem Pharm Bull (Tokyo) 36(7): 2423-2429.(1988) 10.1248/cpb.36.2423
Properties
HBA 8 HBD 4
HeavyAtoms 29 AlogP 0.26
TPSA 125.68 RotatableBonds 3
FractionCSP3 0.86 Rings 4
AromaticRings 0 AliphaticRings 4