TPCN03773

Name Coumoside A
Molecular Formula C58H92O27
Molecular Weight 1221.35
CAS Registry Number 211998-38-8
SMILES CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7OC7OCC(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC41C)C3C2
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Primulaceae Cyclamen coum Whole plants 0.000747% Phytochemistry, 1998, 48, 881-884. 10.1016/s0031-9422(97)00978-3
Properties
HBA 27 HBD 15
HeavyAtoms 85 AlogP -3.94
TPSA 422.05 RotatableBonds 13
FractionCSP3 0.95 Rings 12
AromaticRings 0 AliphaticRings 12