Showing metabocard for Questinol (MMDBc0020499)

Microbial
Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 10:38:04 UTC
Update Date2022-08-27 06:30:59 UTC
Metabolite IDMMDBc0020499
Metabolite Identification
Common NameQuestinol
DescriptionQuestinol belongs to the class of organic compounds known as hydroxyanthraquinones. Hydroxyanthraquinones are compounds containing a hydroxyanthraquinone moiety, which consists of an anthracene bearing a quinone, and hydroxyl group. Questinol has been detected, but not quantified in, green vegetables. This could make questinol a potential biomarker for the consumption of these foods. Based on a literature review a significant number of articles have been published on Questinol.
Structure
MOLSDFPDBSMILESInChI

MOL for #<Metabolite:0x00007f8d860ced18>

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3D MOL for #<Metabolite:0x00007f8d860ced18>

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3D SDF for #<Metabolite:0x00007f8d860ced18>

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3D-SDF for #<Metabolite:0x00007f8d860ced18>

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PDB for #<Metabolite:0x00007f8d860ced18>

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3D PDB for #<Metabolite:0x00007f8d860ced18>

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SMILES for #<Metabolite:0x00007f8d860ced18>

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INCHI for #<Metabolite:0x00007f8d860ced18>

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Synonyms
ValueSource
1,6-Dihydroxy-3-(hydroxymethyl)-8-methoxy-9,10-anthracenedioneKegg
1,6-Dihydroxy-3-hydroxymethyl-8-methoxyanthraquinoneHMDB
Molecular FormulaC16H12O6
Average Mass300.2629
Monoisotopic Mass300.063388116
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C16H12O6/c1-22-12-5-8(18)4-10-14(12)16(21)13-9(15(10)20)2-7(6-17)3-11(13)19/h2-5,17-19H,6H2,1H3
InChI KeySNBGJGNOQURXCI-UHFFFAOYSA-N