TPCN02313

Name Capsianoside II
Molecular Formula C50H84O25
Molecular Weight 1085.20
CAS Registry Number 121961-80-6
SMILES C=CC(C)(CCC=C(C)CCC=C(C)CCC=C(C)COC1OC(C)C(O)C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)C1O)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Solanaceae Capsicum annuum Fruits 0.002768% Chem Pharm Bull (Tokyo) 54, 1365-1369 (2006). 10.1248/cpb.54.1365
Properties
HBA 25 HBD 15
HeavyAtoms 75 AlogP -3.73
TPSA 395.75 RotatableBonds 24
FractionCSP3 0.84 Rings 5
AromaticRings 0 AliphaticRings 5