EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H22N2O14P2 |
| Net Charge | 0 |
| Average Mass | 528.300 |
| Monoisotopic Mass | 528.05463 |
| SMILES | Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@@H]3C=C(O)C(=O)[C@@H](C)O3)O2)c(=O)nc1=O |
| InChI | InChI=1S/C16H22N2O14P2/c1-7-5-18(16(23)17-15(7)22)12-3-9(19)11(30-12)6-28-33(24,25)32-34(26,27)31-13-4-10(20)14(21)8(2)29-13/h4-5,8-9,11-13,19-20H,3,6H2,1-2H3,(H,24,25)(H,26,27)(H,17,22,23)/t8-,9+,11-,12-,13-/m1/s1 |
| InChIKey | QWDIAMULKXKCNE-NJIBTWPXSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose (CHEBI:90167) has functional parent dTDP-D-glucose (CHEBI:35248) |
| dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose (CHEBI:90167) is a dTDP-sugar (CHEBI:23557) |
| dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose (CHEBI:90167) is conjugate acid of dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose(2−) (CHEBI:88119) |
| Incoming Relation(s) |
| dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose(2−) (CHEBI:88119) is conjugate base of dTDP-2,3-dehydro-2,6-dideoxy-4-keto-α-D-glucose (CHEBI:90167) |
| IUPAC Name |
|---|
| 5'-O-{hydroxy[(hydroxy{[(2R,6R)-4-hydroxy-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}phosphoryl)oxy]phosphoryl}thymidine |
| Synonyms | Source |
|---|---|
| dTDP-(2R,6S)-4-hydroxy-2-methyl-3-oxo-3,6-dihydro-2H-pyran-3(6H)-one | ChEBI |
| dTDP-2,6-dideoxy-D-glycero-hex-2-enos-4-ulose | KEGG COMPOUND |