| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:21:02 UTC |
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| Update Date | 2020-04-22 15:17:07 UTC |
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| BMDB ID | BMDB0006268 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | N-Acetylneuraminate 9-phosphate |
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| Description | N-Acetylneuraminate 9-phosphate is a moderately basic compound (based on its pKa). Within cattle, N-acetylneuraminate 9-phosphate participates in a number of enzymatic reactions. In particular, N-acetylneuraminate 9-phosphate can be biosynthesized from N-acetyl-D-mannosamine 6-phosphate and phosphoenolpyruvic acid; which is mediated by the enzyme sialic acid synthase. In addition, N-acetylneuraminate 9-phosphate can be converted into N-acetylneuraminic acid; which is mediated by the enzyme N-acylneuraminate-9-phosphatase. In cattle, N-acetylneuraminate 9-phosphate is involved in the metabolic pathway called the amino sugar metabolism pathway. |
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| Structure | |
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| Synonyms | | Value | Source |
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| N-Acetylneuraminic acid 9-phosphoric acid | Generator | | (4R,5S,6S)-6-[(2R)-1,2-Dihydroxy-3-(phosphonooxy)propyl]-2,4-dihydroxy-5-[(1-hydroxyethylidene)amino]oxane-2-carboxylate | Generator |
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| Chemical Formula | C11H20NO12P |
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| Average Molecular Weight | 389.25 |
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| Monoisotopic Molecular Weight | 389.072312086 |
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| IUPAC Name | (4R,5S,6S)-6-[(2R)-1,2-dihydroxy-3-(phosphonooxy)propyl]-2,4-dihydroxy-5-[(1-hydroxyethylidene)amino]oxane-2-carboxylic acid |
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| Traditional Name | (4R,5S,6S)-6-[(2R)-1,2-dihydroxy-3-(phosphonooxy)propyl]-2,4-dihydroxy-5-[(1-hydroxyethylidene)amino]oxane-2-carboxylic acid |
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| CAS Registry Number | Not Available |
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| SMILES | [H][C@@](O)(COP(O)(O)=O)C([H])(O)[C@@]1([H])OC(O)(C[C@@]([H])(O)[C@]1([H])N=C(C)O)C(O)=O |
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| InChI Identifier | InChI=1S/C11H20NO12P/c1-4(13)12-7-5(14)2-11(19,10(17)18)24-9(7)8(16)6(15)3-23-25(20,21)22/h5-9,14-16,19H,2-3H2,1H3,(H,12,13)(H,17,18)(H2,20,21,22)/t5-,6-,7+,8?,9+,11?/m1/s1 |
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| InChI Key | SQMNIXJSBCSNCI-VMJABCRBSA-N |
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| Chemical Taxonomy |
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| Classification | Not classified |
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| Ontology |
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| Status | Expected but not Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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