chitotriose (CHEBI:84373)

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CHEBI:84373 - chitotriose

ChEBI ID	CHEBI:84373
ChEBI Name	chitotriose
Stars
Definition	An amino trisaccharide comprising of three 2-amino-2-deoxy-D-glucopyranose units joined by β-(1→4) linkages.
Last Modified	21 January 2016
Submitter	namrata
Downloads	Molfile

Formula	C18H35N3O13
Net Charge	0
Average Mass	501.486
Monoisotopic Mass	501.21699
SMILES	N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](N)[C@H](O[C@H]3[C@H](O)[C@@H](N)C(O)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O
InChI	InChI=1S/C18H35N3O13/c19-7-12(27)14(5(2-23)30-16(7)29)33-18-9(21)13(28)15(6(3-24)32-18)34-17-8(20)11(26)10(25)4(1-22)31-17/h4-18,22-29H,1-3,19-21H2/t4-,5-,6-,7-,8-,9-,10-,11-,12-,13-,14-,15-,16?,17+,18+/m1/s1
InChIKey	RQFQJYYMBWVMQG-NLJWRWSBSA-N

Species of Metabolite	Component	Source	Comments
Thalassiosira pseudonana CCMP1335 (ncbitaxon:296543)	-	MetaboLights (MTBLS154)

Roles Classification

Biological Roles:

eukaryotic metabolite Any metabolite produced during a metabolic reaction in eukaryotes, the taxon that include members of the fungi, plantae and animalia kingdoms.

marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.

ChEBI Ontology

Outgoing Relation(s)
	chitotriose (CHEBI:84373) has role eukaryotic metabolite (CHEBI:75763)
	chitotriose (CHEBI:84373) has role marine metabolite (CHEBI:76507)
	chitotriose (CHEBI:84373) is a amino trisaccharide (CHEBI:59266)

IUPAC Name
2-amino-2-deoxy-β-D-glucopyranosyl-(1→4)-2-amino-2-deoxy-β-D-glucopyranosyl-(1→4)-2-amino-2-deoxy-D-glucopyranose

Manual Xrefs	Databases
HMDB0006578	HMDB

Registry Numbers	Sources
Reaxys:5486835	Reaxys

Citations