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CHEBI:28639 - UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid

ChEBI IDCHEBI:28639
ChEBI NameUDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid
Stars
ASCII NameUDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioic acid
Secondary ChEBI IDsCHEBI:9831, CHEBI:13460, CHEBI:13463, CHEBI:13481, CHEBI:22124, CHEBI:30905
Last Modified13 February 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC35H55N7O26P2
Net Charge0
Average Mass1051.796
Monoisotopic Mass1051.26720
SMILESCC(=O)N[C@H]1C(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)N[C@@H](C)C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@@H](N)C(=O)O)C(=O)O)C(=O)O
InChIInChI=1S/C35H55N7O26P2/c1-13(28(50)40-18(33(56)57)7-8-21(45)39-17(32(54)55)6-4-5-16(36)31(52)53)37-29(51)14(2)64-27-23(38-15(3)44)34(66-19(11-43)25(27)48)67-70(61,62)68-69(59,60)63-12-20-24(47)26(49)30(65-20)42-10-9-22(46)41-35(42)58/h9-10,13-14,16-20,23-27,30,34,43,47-49H,4-8,11-12,36H2,1-3H3,(H,37,51)(H,38,44)(H,39,45)(H,40,50)(H,52,53)(H,54,55)(H,56,57)(H,59,60)(H,61,62)(H,41,46,58)/t13-,14+,16+,17-,18+,19+,20+,23+,24+,25+,26+,27+,30+,34?/m0/s1
InChIKeyQUHLBZKCGUXHGP-AJVQVANPSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid (CHEBI:28639) is a UDP-glycopeptide (CHEBI:35257)
UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid (CHEBI:28639) is conjugate acid of UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−) (CHEBI:58582)
Incoming Relation(s)
UDP-N-acetyl-α-D-muramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid (CHEBI:84805) is a UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid (CHEBI:28639)
UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−) (CHEBI:58582) is conjugate base of UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioic acid (CHEBI:28639)
IUPAC Name 
uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-oxo-1-{[(2S)-1-{[(1R)-4-{[(2S,6R)-6-aminoheptan-2-yl]amino}-1-carboxy-4-oxobutyl]amino}-1-oxopropan-2-yl]amino}propan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate)
Synonym  Source
UDP-Mur2Ac-L-Ala-γ-D-Glu-A2pmIUBMB