Glycoside
GD026526
Name:
2-[(3,4-dihydroxyphenyl)methyl]-2,3-dihydroxybutanedioic acidFormula:
C11H12O8Smiles:
O=C(O)C(O)C(O)(Cc1ccc(O)c(O)c1)C(=O)OAglycone:
Cc1ccc(O)c(O)c1Sugarmoiety:
O=C(O)C(O)C(O)(O)C(=O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.27 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 272.21 | Num_heavy_atoms: | 19 |
| TPSA: | 155.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD06437
Formula: C7H8O2
Smiles:
Cc1ccc(O)c(O)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 0 |
| MolWt: | 124.14 | Num_heavy_atoms: | 9 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
