Met009054: 2,3-di-0-hexanoyl-alpha-glucopyranose
Metabolite Information
Name
2,3-di-0-hexanoyl-alpha-glucopyranose
IUPAC Name
[3-hexanoyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate
Molecular Formula
C18H32O8
Molecular Weight
376.4
Exact Mass
376.209718
SMILES
CCCCCC(=O)OC1C(C(OC(C1OC(=O)CCCCC)O)CO)O
InChIKey
SLOAWEZLWSROFF-UHFFFAOYSA-N
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
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Saccharolipids
Subclass:
NA
Crops containing this metabolite
citrus
ginger
lettuce
peach
ginger
lettuce
peach
Metabolite Spectrum Accession Label