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| Formula | C23H31N5O13P2S |
| Net Charge | 0 |
| Average Mass | 679.538 |
| Monoisotopic Mass | 679.11143 |
| SMILES | [H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])c([H])c(N([H])[H])nc2=O)O[C@]1([H])C([H])([H])O[P@@](=O)(O[H])O[P@@](=O)(O[H])OC([H])([H])C([H])([H])N([H])S(=O)(=O)c1c([H])c([H])c([H])c2c(N(C([H])([H])[H])C([H])([H])[H])c([H])c([H])c([H])c12 |
| InChI | InChI=1S/C23H31N5O13P2S/c1-27(2)16-7-3-6-15-14(16)5-4-8-18(15)44(36,37)25-10-12-38-42(32,33)41-43(34,35)39-13-17-20(29)21(30)22(40-17)28-11-9-19(24)26-23(28)31/h3-9,11,17,20-22,25,29-30H,10,12-13H2,1-2H3,(H,32,33)(H,34,35)(H2,24,26,31)/t17-,20-,21-,22-/m1/s1 |
| InChIKey | OXPWLEWKRGQJQO-BRKWEVRTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5'-O-{[({[2-({[5-(DIMETHYLAMINO)NAPHTHALEN-1-YL]SULFONYL}AMINO)ETHYL]OXY}PHOSPHINATO)OXY]PHOSPHINATO}CYT (CHEBI:39765) is a unclassifieds (CHEBI:27189) |
| Synonym | Source |
|---|---|
| 5'-O-{[({[2-({[5-(DIMETHYLAMINO)NAPHTHALEN-1-YL]SULFONYL}AMINO)ETHYL]OXY}PHOSPHINATO)OXY]PHOSPHINATO}CYT | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 2AA | PDBeChem |