TPCN03599

Name Anchusosid 2
Molecular Formula C48H78O18
Molecular Weight 943.13
CAS Registry Number 72843-50-6
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryophyllaceae Sinocrassula asclepiadea Roots 0.002000% Chem Pharm Bull (Tokyo) 52, 230-237 (2004). 10.1248/cpb.52.230
Properties
HBA 18 HBD 11
HeavyAtoms 66 AlogP 0.71
TPSA 294.98 RotatableBonds 10
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8