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foodcomex_compounds
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Listing Compounds in the FoodComEx Library
If you are interested in aquiring any of the metabolites in the FoodComEx Library, please
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Displaying compound
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FoodComEx ID
Compound Name
Cas
Structure
Formula
Weight
Mono Mass
Production Method
Spectral Data Upon Request
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chemical synthesis
commercial
enzymatic synthesis
isolation from food item/reference material
Clear
PC000352
Pentadecanoic acid
1002-84-2
C15H30O2
242.3975
242.224580204
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
AKSci: 6303AF
Cayman Chemical: 17399
MetaSci: HMDB0000826
Sigma-Aldrich: HMDB0000826
Toronto Research Chemicals: P220480
PC000811
Benzaldehyde
100-52-7
C7H6O
106.1219
106.041864814
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
Glentham: GK5897
MetaSci: HMDB0006115
Sigma-Aldrich: HMDB0006115
Toronto Research Chemicals: B119740
PC000586
Benzyl alcohol
100-51-6
C7H8O
108.1378
108.057514878
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
AKSci: I765
AKSci: HMDB0003119
Glentham: GK3443
MetaSci: HMDB0003119
Toronto Research Chemicals: T536635
PC000697
Terephthalic acid
100-21-0
C8H6O4
166.1308
166.02660868
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
AKSci: D857
MetaSci: HMDB0002428
Sigma-Aldrich: HMDB0002428
Toronto Research Chemicals: T112500
PC000885
4-Methoxybenzoic acid
100-09-4
C8H8O3
152.1473
152.047344122
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
AKSci: A147
AKSci: J90093
PC000625
4-Nitrophenol
100-02-7
C6H5NO3
139.1088
139.026943031
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
AKSci: H447
Glentham: GK3547
MetaSci: HMDB0001232
Sigma-Aldrich: HMDB0001232
Toronto Research Chemicals: N496945
PC000089
riboflavin
376.3639
376.138284392
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
PC000287
protoporphyrin IX
C34H34N4O4
562.6582
562.258005596
commercial
Rosa Vazquez Fresno
vazquezf@ualberta.ca
PC001137
Quercetin 3'-glucuronide
478.3598
478.074740662
commercial
Claudine Manach
claudine.manach@inra.fr
PC001154
2-Methoxy-3-methylpyrazine
C6H8N2O
124.1405
124.063662888
commercial
Augustin Scalbert
scalberta@iarc.fr
PC001179
catechol
110.1106
110.036779436
commercial
Augustin Scalbert
scalberta@iarc.fr
PC001224
Secoisolariciresinol
C20H26O6
362.4168
362.172938564
commercial
Augustin Scalbert
scalberta@iarc.fr
Displaying compound
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