TPCN02645

Name Squarroside VII
Molecular Formula C54H90O20
Molecular Weight 1059.29
CAS Registry Number 1331827-01-0
SMILES CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(C)C(OC5OC(C)C(OC6OC(COC7OC(C)C(O)C(O)C7O)C(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)CO
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Thalictrum squarrosum Aerial parts 0.000463% Chem Pharm Bull (Tokyo) 58, 1043-1046 (2010). 10.1248/cpb.58.1043
Properties
HBA 20 HBD 12
HeavyAtoms 74 AlogP 0.49
TPSA 316.60 RotatableBonds 14
FractionCSP3 0.96 Rings 9
AromaticRings 0 AliphaticRings 9