TPCN00851

Name Cichotyboside
Molecular Formula C30H34O15
Molecular Weight 634.59
CAS Registry Number 1071983-45-3
SMILES CC1=C2C(=O)C(O)C(COC3OC(CO)C(O)C(O)C3O)=C2C2OC(=O)C(C)C2C(OC(=O)C=Cc2ccc(O)c(O)c2)C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Cichorium intybus Seeds 0.033333% J Asian Nat Prod Res 10, 223-231(2008) 10.1080/10286020701590764
Properties
HBA 15 HBD 8
HeavyAtoms 45 AlogP -2.05
TPSA 249.97 RotatableBonds 7
FractionCSP3 0.50 Rings 5
AromaticRings 1 AliphaticRings 4