Glycoside
GD036453
Name:
NoneFormula:
C12H15O5N3Smiles:
Cc1nc2c(ccn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
Cc1nc2c(c(=O)[nH]1)C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 281.27 | Num_heavy_atoms: | 20 |
| TPSA: | 120.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD22984
Formula: C7H6ON3
Smiles:
Cc1nc2c(c(=O)[nH]1)C=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 0 |
| MolWt: | 148.14 | Num_heavy_atoms: | 11 |
| TPSA: | 59.85 | NumAromaticRings: | 1 |
