Glycoside
GD036242
Name:
NoneFormula:
C17H25O11N3Smiles:
O=C(NNC(=O)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)CO)c1ccncc1Aglycone:
[NH]NC(=O)c1ccncc1Sugarmoiety:
O=CC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)COOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.59 |
| AlogP: | -5.26 | Num_rotatable_bonds: | 8 |
| MolWt: | 447.4 | Num_heavy_atoms: | 31 |
| TPSA: | 231.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD22878
Formula: C6H6ON3
Smiles:
[NH]NC(=O)c1ccncc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 136.13 | Num_heavy_atoms: | 10 |
| TPSA: | 65.79 | NumAromaticRings: | 1 |
