EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H29N3O12P2 |
| Net Charge | 0 |
| Average Mass | 529.376 |
| Monoisotopic Mass | 529.12265 |
| SMILES | CN[C@H]1CC[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cc(C)c(=O)nc3=O)C[C@@H]2O)O[C@@H]1C |
| InChI | InChI=1S/C17H29N3O12P2/c1-9-7-20(17(23)19-16(9)22)14-6-12(21)13(30-14)8-28-33(24,25)32-34(26,27)31-15-5-4-11(18-3)10(2)29-15/h7,10-15,18,21H,4-6,8H2,1-3H3,(H,24,25)(H,26,27)(H,19,22,23)/t10-,11+,12+,13-,14-,15-/m1/s1 |
| InChIKey | JRJYBKLGPOKTLS-YXJLRHLOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Saccharopolyspora spinosa (ncbitaxon:60894) | - | PubMed (18345667) |
| Roles Classification |
|---|
| Biological Role: | bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522) has role bacterial metabolite (CHEBI:76969) |
| dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522) is a pyrimidine nucleotide-sugar (CHEBI:61109) |
| dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522) is conjugate acid of dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946) |
| Incoming Relation(s) |
| dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946) is conjugate base of dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522) |
| IUPAC Name |
|---|
| 5'-O-{hydroxy[(hydroxy{[(2R,5S,6R)-6-methyl-5-(methylamino)oxan-2-yl]oxy}phosphoryl)oxy]phosphoryl}thymidine |
| Synonyms | Source |
|---|---|
| dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranose | ChEBI |
| dTDP-N-monodesmethyl-D-forosamine | MetaCyc |
| Manual Xrefs | Databases |
|---|---|
| CPD-13389 | MetaCyc |
| Citations |
|---|