CHEBI:85987 - CMP-3-deoxy-β-D-manno-octulosonate(2−)

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ChEBI Name CMP-3-deoxy-β-D-manno-octulosonate(2−) ChEBI ID CHEBI:85987 ChEBI ASCII Name CMP-3-deoxy-beta-D-manno-octulosonate(2-) Definition A nucleotide-sugar oxoanion arising from deprotonation of the carboxylic acid and phosphate functions of CMP-3-deoxy-β-D-manno-octulosonic acid; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H24N3O15P Net Charge -2 Average Mass 541.35840 Monoisotopic Mass 541.09560 InChI InChI=1S/C17H26N3O15P/c18-9-1-2-20(16(29)19-9)14-12(26)11(25)8(33-14)5-32-36(30,31)35-17(15(27)28)3-6(22)10(24)13(34-17)7(23)4-21/h1-2,6-8,10-14,21-26H,3-5H2,(H,27,28)(H,30,31)(H2,18,19,29)/p-2/t6-,7-,8-,10-,11-,12-,13-,14-,17-/m1/s1 InChIKey YWWJKULNWGRYAS-UOVSKDHASA-L SMILES Nc1ccn([C@@H]2O[C@H](COP([O-])(=O)O[C@]3(C[C@@H](O)[C@@H](O)[C@H](O3)[C@H](O)CO)C([O-])=O)[C@@H](O)[C@H]2O)c(=O)n1 ChEBI Ontology Outgoing CMP-3-deoxy-β-D-manno-octulosonate(2−) (CHEBI:85987) is a nucleotide-sugar oxoanion (CHEBI:59737) CMP-3-deoxy-β-D-manno-octulosonate(2−) (CHEBI:85987) is conjugate base of CMP-3-deoxy-β-D-manno-octulosonic acid (CHEBI:86284) Incoming CMP-3-deoxy-β-D-manno-octulosonic acid (CHEBI:86284) is conjugate acid of CMP-3-deoxy-β-D-manno-octulosonate(2−) (CHEBI:85987) Synonym Source CMP-3-deoxy-β-D-manno-octulosonate UniProt Citation Type Source 20877901 PubMed citation SUBMITTER Last Modified 04 February 2016