CHEBI:83905 - UDP-N-acetyl-α-D-muramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name UDP-N-acetyl-α-D-muramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−)
ChEBI ID CHEBI:83905
ChEBI ASCII Name UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioate(4-)
Definition A UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−) in which the muramoyl moiety has α-configuratijon at its anomeric centre; 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
Formula C35H51N7O26P2
Net Charge -4
Average Mass 1047.76050
Monoisotopic Mass 1047.23809
InChI InChI=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)/p-4/t13-,14+,16+,17-,18+,19+,20+,23+,24+,25+,26+,27+,30+,34+/m0/s1
InChIKey QUHLBZKCGUXHGP-BHBBPGSKSA-J
SMILES C[C@H](NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@@H]1NC(C)=O)C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@@H]([NH3+])C([O-])=O)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing UDP-N-acetyl-α-D-muramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−) (CHEBI:83905) is a UDP-N-acetylmuramoyl-L-alanyl-D-γ-glutamyl-meso-2,6-diaminoheptanedioate(4−) (CHEBI:58582)
Synonym Source
UDP-N-acetyl-α-D-muramoyl-L-alanyl-γ-D-glutamyl-meso-diaminopimelate UniProt
Manual Xref Database
UDP-AAGM-DIAMINOHEPTANEDIOATE MetaCyc
View more database links
Last Modified
13 February 2015