Glycoside
GD119306
Name:
2-{[3-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C24H30O12Smiles:
COc1cc(C2Oc3cc(OC4OC(CO)C(O)C(O)C4O)cc(OC)c3CC2O)cc(OC)c1OAglycone:
COc1cc(C2Oc3cc(O)cc(OC)c3CC2O)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 510.49 | Num_heavy_atoms: | 36 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD47774
Formula: C18H20O7
Smiles:
COc1cc(C2Oc3cc(O)cc(OC)c3CC2O)cc(OC)c1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.35 | Num_heavy_atoms: | 25 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
