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CHEBI:135873 - glucosaminylmuramyl dipeptide

ChEBI IDCHEBI:135873
ChEBI Nameglucosaminylmuramyl dipeptide
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC27H45N5O16
Net Charge0
Average Mass695.676
Monoisotopic Mass695.28613
SMILES[H][C@@](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O)([C@H](O)CO)[C@H](O[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)O)C(N)=O)[C@H](C=O)NC(C)=O
InChIInChI=1S/C27H45N5O16/c1-10(25(44)32-14(24(28)43)5-6-18(39)40)29-26(45)11(2)46-22(15(7-33)30-12(3)36)23(16(38)8-34)48-27-19(31-13(4)37)21(42)20(41)17(9-35)47-27/h7,10-11,14-17,19-23,27,34-35,38,41-42H,5-6,8-9H2,1-4H3,(H2,28,43)(H,29,45)(H,30,36)(H,31,37)(H,32,44)(H,39,40)/t10-,11+,14+,15-,16+,17+,19+,20+,21+,22+,23+,27-/m0/s1
InChIKeyJPBBNLWRCVBGJS-KCAUTNRHSA-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)
glucosaminylmuramyl dipeptide (CHEBI:135873) is a dipeptide (CHEBI:46761)
Synonyms  Source
licopidDrugCentral
glycopinDrugCentral
Manual XrefsDatabases
1322DrugCentral
Registry NumbersSources
CAS:70280-03-4DrugCentral