Spectrum PB005715 for Genistein

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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
Natural Product
InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
TZBJGXHYKVUXJN-UHFFFAOYSA-N
C15H10O5
270.05282342
O=C1C(=COC=2C=C(O)C=C(O)C12)C=3C=CC(O)=CC3

Mass Spectral Metadata

NameValue
PB005715
2016.01.19 (Created 2009.02.18, modified 2013.06.04)
Heinz T, Institute of Plant Biochemistry, Halle, Germany
CC BY-SA
270.05282
micrOTOF-Q
LC-ESI-QTOF
MS2
25 eV
ESI
positive
2.966498475040723
0.6470053471133604
[M+H]+
271.06079342
0.0 ppm
0.0 Da