Glycoside
GD122781
Name:
Mucic Acid Dimethyl Ester 2-O-GallateFormula:
C15H18O12Smiles:
COC(=O)C(O)C(O)C(O)C(OC(=O)c1cc(O)c(O)c(O)c1)C(=O)OCAglycone:
O=Cc1cc(O)c(O)c(O)c1Sugarmoiety:
COC(=O)C(O)C(O)C(O)C(OO)C(=O)OCOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 7 |
| MolWt: | 390.3 | Num_heavy_atoms: | 27 |
| TPSA: | 200.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD02035
Formula: C7H6O4
Smiles:
O=Cc1cc(O)c(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.12 | Num_heavy_atoms: | 11 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
