Glycoside
GD156409
Name:
2-methyl-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromene-5-carboxylic acidFormula:
C17H18O10Smiles:
Cc1cc(=O)c2c(C(=O)O)cc(OC3OC(CO)C(O)C(O)C3O)cc2o1Aglycone:
Cc1cc(=O)c2c(C(=O)O)cc(O)cc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 382.32 | Num_heavy_atoms: | 27 |
| TPSA: | 166.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD61938
Formula: C11H8O5
Smiles:
Cc1cc(=O)c2c(C(=O)O)cc(O)cc2o1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 220.18 | Num_heavy_atoms: | 16 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
