Glycoside
GD015273
Name:
NoneFormula:
C12H14O7N2Smiles:
O=C(NC1OC(C(=O)O)C(O)C(O)C1O)c1ccncc1Aglycone:
NC(=O)c1ccncc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.25 | Num_heavy_atoms: | 21 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD11121
Formula: C6H6ON2
Smiles:
NC(=O)c1ccncc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.13 | Num_heavy_atoms: | 9 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
