Glycoside
GD038273
Name:
[[(2r,3s,4r,5r)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-(2-hydroxyethyl)phosphinic acidFormula:
C11H19O11N3P2Smiles:
Nc1ccn([C@H]2O[C@H](COP(=O)(O)OP(=O)(O)CCO)[C@H](O)[C@@H]2O)c(=O)n1Aglycone:
COP(=O)(O)OP(=O)(O)CCO.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.64 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.23 | Num_heavy_atoms: | 27 |
| TPSA: | 223.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD23940
Formula: C3H10O7P2
Smiles:
COP(=O)(O)OP(=O)(O)CCO| HBA: | 7 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 220.05 | Num_heavy_atoms: | 12 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
