Glycoside
GD141319
Name:
3,4,5-trihydroxy-6-[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)oxy]oxane-2-carboxylic acidFormula:
C13H13O9NSmiles:
O=C(O)C1OC(Oc2ccc3nc(O)oc3c2)C(O)C(O)C1OAglycone:
Oc1ccc2nc(O)oc2c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.25 | Num_heavy_atoms: | 23 |
| TPSA: | 162.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD46059
Formula: C7H5O3N
Smiles:
Oc1ccc2nc(O)oc2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 151.12 | Num_heavy_atoms: | 11 |
| TPSA: | 66.49 | NumAromaticRings: | 2 |
