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CHEBI:169058 - Galactopinitol B

Default Structure
ChEBI IDCHEBI:169058
ChEBI NameGalactopinitol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24O11
Net Charge0
Average Mass356.324
Monoisotopic Mass356.13186
SMILESCO[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C13H24O11/c1-22-11-7(18)6(17)8(19)12(10(11)21)24-13-9(20)5(16)4(15)3(2-14)23-13/h3-21H,2H2,1H3/t3-,4+,5+,6-,7+,8+,9-,10+,11-,12+,13+/m1/s1
InChIKeyWFSVEMFCPALUBB-DVLBVPSGSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Galactopinitol B (CHEBI:169058) is a glycoside (CHEBI:24400)
IUPAC Name 
(1S,2R,3S,4R,5S,6S)-4-methoxy-6-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexane-1,2,3,5-tetrol
Manual XrefsDatabases
30777082ChemSpider
HMDB0035321HMDB