Glycoside
GD039352
Name:
6-o-phosphoryl inosine monophosphateFormula:
C10H14O11N4P2Smiles:
O=P(O)(O)OC[C@H]1O[C@H](n2cnc3c(OP(=O)(O)O)ncnc32)[C@@H](O)[C@H]1OAglycone:
COP(=O)(O)O.O=P(O)(O)Oc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 6 |
| MolWt: | 428.19 | Num_heavy_atoms: | 27 |
| TPSA: | 226.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD24366
Formula: C5H4O4N4P
Smiles:
O=P(O)(O)Oc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 215.09 | Num_heavy_atoms: | 14 |
| TPSA: | 119.0 | NumAromaticRings: | 1 |
