Glycoside

GD132618
Name:
1'''-O-Beta-GlucosylfraxiformosideFormula:
C38H48O18Smiles:
CC=C1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)Oc1ccc(CCOC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
CC=C1C(O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)Oc1ccc(CCO)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 5 |
HBD: | 9 | FractionCSP3: | 0.53 |
AlogP: | -1.55 | Num_rotatable_bonds: | 15 |
MolWt: | 792.78 | Num_heavy_atoms: | 56 |
TPSA: | 280.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD53694
Formula: C26H28O8
Smiles:
CC=C1C(O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)Oc1ccc(CCO)cc1HBA: | 8 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.31 |
AlogP: | 2.8 | Num_rotatable_bonds: | 9 |
MolWt: | 468.5 | Num_heavy_atoms: | 34 |
TPSA: | 122.52 | NumAromaticRings: | 2 |