CHEBI:8006 - Peptidoglycan(N-acetyl-D-glucosamine)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Peptidoglycan(N-acetyl-D-glucosamine)
ChEBI ID CHEBI:8006
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C34H60N8O18
Net Charge 0
Average Mass 868.884
Monoisotopic Mass 868.40256
InChI InChI=1S/C34H60N8O18/c1-13(28(49)42-19(12-56-36)31(52)41-18(8-6-7-9-35)30(51)38-14(2)32(53)54)37-29(50)15(3)57-27-23(40-17(5)46)33(55)58-21(11-44)26(27)60-34-22(39-16(4)45)25(48)24(47)20(10-43)59-34/h13-15,18-27,33-34,43-44,47-48,55H,6-12,35-36H2,1-5H3,(H,37,50)(H,38,51)(H,39,45)(H,40,46)(H,41,52)(H,42,49)(H,53,54)/t13-,14+,15+,18-,19+,20+,21+,22+,23+,24+,25+,26+,27+,33+,34-/m0/s1
InChIKey CKCOYJUVSJOCOA-DCHKRTDBSA-N
SMILES C[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CON)NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@@H]1[C@@H](NC(C)=O)[C@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O)C(O)=O
ChEBI Ontology
Outgoing Peptidoglycan(N-acetyl-D-glucosamine) (CHEBI:8006) is a polyol (CHEBI:26191)
Synonyms Sources
Peptideglycan(N-acetyl-D-glucosamine) KEGG COMPOUND
Peptidoglycan(N-acetyl-D-glucosamine) KEGG COMPOUND
Manual Xref Database
C04394 KEGG COMPOUND
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Last Modified
28 July 2014