Glycoside
GD005088
Name:
NoneFormula:
C12H16O5N4Smiles:
C[C@]1(O)[C@H](c2ccc3c(=O)[nH]c(N)nn23)O[C@H](CO)[C@H]1OAglycone:
Nc1nn2cccc2c(=O)[nH]1Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 296.28 | Num_heavy_atoms: | 21 |
| TPSA: | 146.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD04355
Formula: C6H6ON4
Smiles:
Nc1nn2cccc2c(=O)[nH]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.14 | Num_heavy_atoms: | 11 |
| TPSA: | 76.18 | NumAromaticRings: | 2 |
