Glycoside
GD062522
Name:
NoneFormula:
C14H22O5N7Smiles:
Nc1nc2c(nc(N3CC[NH2+]CC3)n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
Nc1nc2c(c(=O)[nH]1)N=C(N1CC[NH2+]CC1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.64 |
| AlogP: | -4.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 368.37 | Num_heavy_atoms: | 26 |
| TPSA: | 179.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD30339
Formula: C9H13ON7
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C(N1CC[NH2+]CC1)[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -2.53 | Num_rotatable_bonds: | 0 |
| MolWt: | 235.25 | Num_heavy_atoms: | 17 |
| TPSA: | 118.08 | NumAromaticRings: | 1 |
