Glycoside
GD022534
Name:
NoneFormula:
C16H23O7N8PSmiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC[C@H](N)Cc2c[nH]cn2)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)OCC(N)Cc1c[nH]cn1.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -1.55 | Num_rotatable_bonds: | 9 |
| MolWt: | 470.38 | Num_heavy_atoms: | 32 |
| TPSA: | 229.77 | NumAromaticRings: | 3 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD15262
Formula: C7H14O4N3P
Smiles:
COP(=O)(O)OCC(N)Cc1c[nH]cn1| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 235.18 | Num_heavy_atoms: | 15 |
| TPSA: | 110.46 | NumAromaticRings: | 1 |
