Glycoside
GD040206
Name:
5-{[(2-sulfoethyl)amino]methyl}uridine 5'-(dihydrogen phosphate)Formula:
C12H20O12N3PSSmiles:
O=c1[nH]c(=O)n([C@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]2O)cc1CNCCS(=O)(=O)OAglycone:
COP(=O)(O)O.O=c1[nH]cc(CNCCS(=O)(=O)O)c(=O)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.67 |
| AlogP: | -3.76 | Num_rotatable_bonds: | 9 |
| MolWt: | 461.34 | Num_heavy_atoms: | 29 |
| TPSA: | 237.71 | NumAromaticRings: | 1 |
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 |
AD24696
Formula: C7H11O5N3S
Smiles:
O=c1[nH]cc(CNCCS(=O)(=O)O)c(=O)[nH]1| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 249.25 | Num_heavy_atoms: | 16 |
| TPSA: | 132.12 | NumAromaticRings: | 1 |
