TPCN02528

Name Capsianoside X
Molecular Formula C56H94O31
Molecular Weight 1263.34
CAS Registry Number 919121-14-5
SMILES C=CC(C)(CCC=C(C)CCC=C(C)CCC=C(C)COC1OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Solanaceae Capsicum annuum Fruits 0.000819% Chem Pharm Bull (Tokyo) 54, 1365-1369 (2006). 10.1248/cpb.54.1365
Properties
HBA 31 HBD 19
HeavyAtoms 87 AlogP -6.93
TPSA 495.13 RotatableBonds 28
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6