CHEBI:68670 - CMP-N,N-diacetyllegionaminate(2−)

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ChEBI Name CMP-N,N-diacetyllegionaminate(2−) ChEBI ID CHEBI:68670 ChEBI ASCII Name CMP-N,N-diacetyllegionaminate(2-) Definition A nucleotide-sugar oxoanion obtained by deprotonation of carboxy and phosphate groups of CMP-N,N-diacetyllegionaminate; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information No supplier information found for this compound. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H32N5O15P Net Charge -2 Average Mass 637.48770 Monoisotopic Mass 637.16435 InChI InChI=1S/C22H34N5O15P/c1-8(28)14(24-9(2)29)18-15(25-10(3)30)11(31)6-22(41-18,20(34)35)42-43(37,38)39-7-12-16(32)17(33)19(40-12)27-5-4-13(23)26-21(27)36/h4-5,8,11-12,14-19,28,31-33H,6-7H2,1-3H3,(H,24,29)(H,25,30)(H,34,35)(H,37,38)(H2,23,26,36)/p-2/t8-,11+,12-,14-,15-,16-,17-,18+,19-,22-/m1/s1 InChIKey XTZJKGIMUFZFBV-QBAABWDMSA-L SMILES [H][C@]1(O[C@](C[C@H](O)[C@H]1NC(C)=O)(OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O)C([O-])=O)[C@H](NC(C)=O)[C@@H](C)O ChEBI Ontology Outgoing CMP-N,N-diacetyllegionaminate(2−) (CHEBI:68670) is a nucleotide-sugar oxoanion (CHEBI:59737) CMP-N,N-diacetyllegionaminate(2−) (CHEBI:68670) is conjugate base of CMP-N,N-diacetyllegionaminic acid (CHEBI:68683) Incoming CMP-N,N-diacetyllegionaminic acid (CHEBI:68683) is conjugate acid of CMP-N,N-diacetyllegionaminate(2−) (CHEBI:68670) IUPAC Name cytidine 5'-(5,7-diacetamido-3,5,7,9-tetradeoxy-D-glycero-β-D-galacto-non-2-ulopyranosylonate monophosphate) Synonym Source CMP-N,N-diacetyllegionaminate UniProt Manual Xref Database CPD-13167 MetaCyc View more database links Citation Type Source 18275154 PubMed citation SUBMITTER Last Modified 11 October 2012