CHEBI:194552 - 1-O-Benzoylhexopyranose

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ChEBI Name 1-O-Benzoylhexopyranose
ChEBI ID CHEBI:194552
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O7
Net Charge 0
Average Mass 284.264
Monoisotopic Mass 284.08960
InChI InChI=1S/C13H16O7/c14-6-8-9(15)10(16)11(17)13(19-8)20-12(18)7-4-2-1-3-5-7/h1-5,8-11,13-17H,6H2
InChIKey LVFCLUMIBMHAFL-UHFFFAOYSA-N
SMILES O1C(C(O)C(O)C(O)C1OC(=O)C2=CC=CC=C2)CO
ChEBI Ontology
Outgoing 1-O-Benzoylhexopyranose (CHEBI:194552) is a hexose (CHEBI:18133)
IUPAC Name
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] benzoate
Manual Xref Database
278164 ChemSpider
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