2,3-di-0-hexanoyl-alpha-glucopyranose (CHEBI:168963)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	2,3-di-0-hexanoyl-alpha-glucopyranose

ChEBI ID	CHEBI:168963

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H32O8

Net Charge

Average Mass

376.446

Monoisotopic Mass

376.20972

InChI

InChI=1S/C18H32O8/c1-3-5-7-9-13(20)25-16-15(22)12(11-19)24-18(23)17(16)26-14(21)10-8-6-4-2/h12,15-19,22-23H,3-11H2,1-2H3

InChIKey

SLOAWEZLWSROFF-UHFFFAOYSA-N

SMILES

O1C(C(O)C(OC(=O)CCCCC)C(OC(=O)CCCCC)C1O)CO

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

ChEBI Ontology
Outgoing	2,3-di-0-hexanoyl-alpha-glucopyranose (CHEBI:168963) is a lipopolysaccharide (CHEBI:16412)

IUPAC Name

[3-hexanoyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate