UDP-N-acetyl-alpha-D-muramic acid (CHEBI:70765)

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CHEBI:70765 - UDP-N-acetyl-α-D-muramic acid

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ChEBI ID	CHEBI:70765
ChEBI Name	UDP-N-acetyl-α-D-muramic acid
Stars
ASCII Name	UDP-N-acetyl-alpha-D-muramic acid
Definition	A UDP-N-acetyl-D-muramate in which the anomeric centre of the pyranose fragment has α-configuration.
Last Modified	28 July 2014
Submitter	Steve
Downloads	Molfile

Formula	C20H31N3O19P2
Net Charge	0
Average Mass	679.418
Monoisotopic Mass	679.10270
SMILES	CC(=O)N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O
InChI	InChI=1S/C20H31N3O19P2/c1-7(18(30)31)38-16-12(21-8(2)25)19(40-9(5-24)14(16)28)41-44(35,36)42-43(33,34)37-6-10-13(27)15(29)17(39-10)23-4-3-11(26)22-20(23)32/h3-4,7,9-10,12-17,19,24,27-29H,5-6H2,1-2H3,(H,21,25)(H,30,31)(H,33,34)(H,35,36)(H,22,26,32)/t7-,9-,10-,12-,13-,14-,15-,16-,17-,19-/m1/s1
InChIKey	NQBRVZNDBBMBLJ-MQTLHLSBSA-N

ChEBI Ontology

Outgoing Relation(s)
	UDP-N-acetyl-α-D-muramic acid (CHEBI:70765) is a UDP-N-acetylmuramic acid (CHEBI:17882)
	UDP-N-acetyl-α-D-muramic acid (CHEBI:70765) is conjugate acid of UDP-N-acetyl-α-D-muramate(3−) (CHEBI:70757)
Incoming Relation(s)
	UDP-N-acetyl-α-D-muramate(3−) (CHEBI:70757) is conjugate base of UDP-N-acetyl-α-D-muramic acid (CHEBI:70765)

IUPAC Name
uridine 5'-(3-{2-acetylamino-3-O-[(R)-1-carboxyethyl]-2-deoxy-α-D-glucopyranosyl} dihydrogen diphosphate)

Synonyms	Source
UDP-MurNAc	KEGG COMPOUND
UDP-N-acetylmuramic acid	KEGG COMPOUND

Manual Xrefs	Databases
C00019555	KNApSAcK
C01050	KEGG COMPOUND
EPZ	PDBeChem
UDP-N-ACETYLMURAMATE	MetaCyc

Registry Numbers	Sources
Reaxys:77166	Reaxys