Glycoside
GD026386
Name:
MONNIERISIDE FFormula:
C21H24O10Smiles:
C=C(C)C1Cc2c(cc3oc(CO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc(=O)c3c2O)O1Aglycone:
C=C(C)C1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 436.41 | Num_heavy_atoms: | 31 |
| TPSA: | 159.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD17396
Formula: C15H14O5
Smiles:
C=C(C)C1Cc2c(cc3oc(CO)cc(=O)c3c2O)O1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
