Spectrum MetaboBASE0464 for Eriodictyol

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
C15H12O6
288.06338810399996
O=C1C=2C(O)=CC(O)=CC2OC(C3=CC=C(O)C(O)=C3)C1
InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2
SBHXYTNGIZCORC-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
License CC-BY-NC-SA 4.0 International
Plant Biology, The Noble Foundation, Ardmore, OK, US/Dennis Fine, Daniel Wherritt, and Lloyd Sumner
LC-ESI-TOF
impact HD
ESI
negative
MS2
5
Nitrogen
10
0.014
2013-11-23 08:11:52+01:00
Waters Acquity BEH C18 1.7um x 2.1 x 150 mm
456.6
C:\Data\Confirmed Standards\Confirmed stds MSMS 22Nov13\Eridodictyol (vial 259) MSMS.d
1.509963904112247
0.6557689914290397
285.0393