Glycoside
GD018972
Name:
NoneFormula:
C11H14O6N4Smiles:
CO[C@@H]1[C@H](O)[C@H](CO)O[C@H]1n1cnc2c(=O)[nH][nH]c(=O)c21Aglycone:
O=c1[nH][nH]c(=O)c2c1[N]C=N2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -2.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.26 | Num_heavy_atoms: | 21 |
| TPSA: | 142.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD13296
Formula: C5H3O2N4
Smiles:
O=c1[nH][nH]c(=O)c2c1[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 151.11 | Num_heavy_atoms: | 11 |
| TPSA: | 92.18 | NumAromaticRings: | 1 |
