OntologieschebiclassesCHEBI:28681   
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N,N'-diacetylchitobiose
http://purl.obolibrary.org/obo/CHEBI_28681

The N,N'-diacetylated derivative of chitobiose, but with no stereodesignation for the anomeric carbon atom.

Also appears inslmgomco
Exact Synonyms
2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-D-glucopyranose
N,N'-Diacetylchitobiose
N,N'-diacetylchitobiose
Related Synonyms
Chitobiose
Diacetylchitobiose
WURCS=2.0/2,2,1/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O]/1-2/a4-b1
class Information
charge

0

formula

C16H28N2O11

has_alternative_id
has_obo_namespace

chebi_ontology

inchi

InChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)14(8(4-20)27-15(9)26)29-16-10(18-6(2)22)12(24)11(23)7(3-19)28-16/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11-,12-,13-,14-,15?,16+/m1/s1

inchikey

CDOJPCSDOXYJJF-CBTAGEKQSA-N

in_subset

3_STAR

mass

424.40040

monoisotopicmass

424.16931

smiles

CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O

class Relations