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CHEBI:168283 - DIBOA-Glc

ChEBI IDCHEBI:168283
ChEBI NameDIBOA-Glc
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H17NO9
Net Charge0
Average Mass343.288
Monoisotopic Mass343.09033
SMILESO=C1C(OC2OC(CO)C(O)C(O)C2O)Oc2ccccc2N1O
InChIInChI=1S/C14H17NO9/c16-5-8-9(17)10(18)11(19)13(23-8)24-14-12(20)15(21)6-3-1-2-4-7(6)22-14/h1-4,8-11,13-14,16-19,21H,5H2
InChIKeyOUSLYTBGQGKTME-UHFFFAOYSA-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)
DIBOA-Glc (CHEBI:168283) is a glycoside (CHEBI:24400)
IUPAC Name 
4-hydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4-benzoxazin-3-one
Manual XrefsDatabases
74886401ChemSpider
HMDB0033734HMDB