CAS: 924-44-7 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00044009 InChI Key: DBPFRRFGLYGEJI-UHFFFAOYSA-N Synonym: 2-oxoacetic acid, ethyl ester, ixx9mq1j1i, acetic acid, 2-oxo-, ethyl ester, unii-ixx9mq1j1i, ethyl glyoxalate solution, acetic acid, oxo-, ethyl ester, glyoxylic acid ethyl ester, ethyl oxoacetate, ethyl glyoxylate, ethyl glyoxalate PubChem CID: 70211 ChEBI: CHEBI:53275 IUPAC Name: ethyl 2-oxoacetate SMILES: CCOC(=O)C=O

CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00148910 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: krystar 300, fructose, d, sugar, fruit, d-levulose, keto-d-fructose, arabino-hexulose, furucton, 3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one, d--fructose, d---fructose PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

CAS: 127-17-3 Molecular Formula: C3H4O3 Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: 2-oxopropansaeure, 2-oxo-propionic acid, propanoic acid, 2-oxo, 2-oxopropanoate, 2-ketopropionic acid, alpha-ketopropionic acid, acetylformic acid, 2-oxopropionic acid, pyroracemic acid, pyruvic acid PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(O)=O

CAS: 498-02-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00008747 InChI Key: DFYRUELUNQRZTB-UHFFFAOYSA-N Synonym: acetovanyllon, acetovanilone, 4-acetyl-2-methoxyphenol, apocynine, acetoguaiacon, acetoguaiacone, 1-4-hydroxy-3-methoxyphenyl ethanone, 4'-hydroxy-3'-methoxyacetophenone, apocynin, acetovanillone PubChem CID: 2214 ChEBI: CHEBI:2781 IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)ethanone SMILES: COC1=CC(=CC=C1O)C(C)=O

CAS: 75-07-0 Molecular Formula: C₂H₄O Molecular Weight (g/mol): 44.04 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: aldehyde acetique, octowy aldehyd, aldeide acetica, acetic ethanol, aldehyde, acetylaldehyde, acetaldehyd, ethyl aldehyde, acetic aldehyde, ethanal PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O

CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: 148910 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: krystar 300, fructose, d, sugar, fruit, d-levulose, keto-d-fructose, arabino-hexulose, furucton, 3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one, d--fructose, d---fructose PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

CAS: 123-38-6 Molecular Formula: C3H6O Molecular Weight (g/mol): 58.08 MDL Number: MFCD00007020 InChI Key: NBBJYMSMWIIQGU-UHFFFAOYSA-N Synonym: aldehyde propionique, propylic aldehyde, propylaldehyde, methylacetaldehyde, n-propanal, propionic aldehyde, propional, propaldehyde, propanaldehyde, propionaldehyde PubChem CID: 527 ChEBI: CHEBI:17153 IUPAC Name: propanal SMILES: CCC=O

CAS: 959-36-4 Molecular Formula: C₁₄H₁₂N₂O₂ Molecular Weight (g/mol): 240.26 InChI Key: SPEXYYIULCBQJR-UHFFFAOYSA-N Synonym: 6-6-oxo-1-cyclohexa-2,4-dienylidene methylhydrazo methylidene-1-cyclohexa-2,4-dienone, 1,2-bis e-salicylidene hydrazine, benzaldehyde, 2-hydroxy-, 2-2-hydroxyphenyl methylene hydrazone, 2,2'-1,2-hydrazinediylidenedi methylylidene diphenol, 2-1e-e-2-2-hydroxyphenyl methylidene hydrazin-1-ylidene methyl phenol, 2-hydroxybenzaldehyde azine, benzaldehyde, 2-hydroxy-, 2-hydroxyphenyl methylene hydrazone, salicylaldazine, salicylalazine, salicylaldehyde azine PubChem CID: 6849893 IUPAC Name: 6-[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one SMILES: C1=CC(=CNNC=C2C=CC=CC2=O)C(=O)C=C1

CAS: 6363-53-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00149343 InChI Key: HBDJFVFTHLOSDW-UHFFFAOYNA-N Synonym: d-+-maltose monohydrate, bioxtra, d-+-maltose monohydrate, analytical standard, d-+-maltose monohydrate, puriss., d +-maltose monohydrate, 69-79-4 anhydrous, d-+-maltosemonohydrate, beta-maltose monohydrate, 2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate, unii-dm477ee40d, d-+-maltose monohydrate IUPAC Name: 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate SMILES: O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O

CAS: 1522-22-1 Molecular Formula: C₅H₂F₆O₂ Molecular Weight (g/mol): 208.06 InChI Key: QAMFBRUWYYMMGJ-UHFFFAOYSA-N Synonym: 2,4-dioxo-1,1,1,5,5,5-hexafluoropentane, 1,1,1-trifluoro-3-trifluoroacetyl acetone, 1,3-bis trifluoromethyl propane-1,3-dione, 1,1,1,5,5,5-hexafluoro-2,4-pentadione, hfac, hexafluoro-2,4-pentanedione, 2,4-pentanedione, 1,1,1,5,5,5-hexafluoro, 1,1,1,5,5,5-hexafluoro-2,4-pentanedione, 1,1,1,5,5,5-hexafluoroacetylacetone, hexafluoroacetylacetone PubChem CID: 73706 IUPAC Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione SMILES: C(C(=O)C(F)(F)F)C(=O)C(F)(F)F

CAS: 6363-53-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00149343 InChI Key: HBDJFVFTHLOSDW-UHFFFAOYNA-N Synonym: d-+-maltose monohydrate, bioxtra, d-+-maltose monohydrate, analytical standard, d-+-maltose monohydrate, puriss., d +-maltose monohydrate, 69-79-4 anhydrous, d-+-maltosemonohydrate, beta-maltose monohydrate, 2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate, unii-dm477ee40d, d-+-maltose monohydrate IUPAC Name: 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate SMILES: O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O

CAS: 5362-56-1 Molecular Formula: C₆H₁₀O Molecular Weight (g/mol): 98.14 MDL Number: MFCD00800501 InChI Key: RIWPMNBTULNXOH-ONEGZZNKSA-N Synonym: 2e-4-methylpent-2-enal, 2-pentenal, 4-methyl-, 2e, 4-methyl-2-penten-1-al, 4-methylpent-2-enal, 2-pentenal, 4-methyl, fema no. 3510, sxg1guk91a, e-4-methyl-2-pentenal, unii-sxg1guk91a, 4-methyl-2-pentenal PubChem CID: 5916154 IUPAC Name: (E)-4-methylpent-2-enal SMILES: CC(C)C=CC=O

CAS: 3997-89-5 Molecular Formula: C5H8O Molecular Weight (g/mol): 88.142 MDL Number: MFCD00190415 InChI Key: BGTOWKSIORTVQH-KHORGVISSA-N Synonym: 2,2,5,5-2 h? cyclopentan-1-one, cyclopentanone-2,2,5,5-d4, 98 atom % d, 2,2,5,5-∼2∼h_4_ cyclopentanone, cyclopentanone d4, cyclopentanone-2,2,5,5-d4 PubChem CID: 16213326 IUPAC Name: 2,2,5,5-tetradeuteriocyclopentan-1-one SMILES: C1CCC(=O)C1

CAS: 615-94-1 Molecular Formula: C6H4O4 Molecular Weight (g/mol): 140.09 MDL Number: MFCD00001598 InChI Key: QFSYADJLNBHAKO-UHFFFAOYSA-N Synonym: 2,5-dhbqop, 2,5-dihydroxy benzoquinone, 2,5-dihydroxy-p-quinone, 4lbp, 2,5-dihydroxybenzoquinone, p-benzoquinone, 2,5-dihydroxy, 2,5-cyclohexadiene-1,4-dione, 2,5-dihydroxy, 2,5-dihydroxy-p-benzoquinone, 2,5-dihydroxy-1,4-benzoquinone PubChem CID: 69213 IUPAC Name: 2,5-dihydroxycyclohexa-2,5-diene-1,4-dione SMILES: OC1=CC(=O)C(O)=CC1=O

CAS: 4272-74-6 Molecular Formula: C14H22Cl2N2O3S Molecular Weight (g/mol): 369.30 MDL Number: MFCD00065395 InChI Key: YFCUZWYIPBUQBD-ZOWNYOTGSA-N Synonym: p-toluenesulfonamide, n-5-amino-1-chloroacetyl pentyl-, hydrochloride, l, l-n-5-amino-1-chloroacetyl pentyl-p-toluenesulfonamide hydrochloride, tosyl-l-lysyl-chloromethane hydrochloride, c14h21cln2o3s hydrochloride, na-p-tosyl-l-lysine chloromethyl ketone hydrochloride, n-alpha-p-tosyl-l-lysine chloromethyl ketone hydrochloride, 3s-1-chloro-3-tosylamido-7-amino-2-heptanone hydrochloride, s-n-7-amino-1-chloro-2-oxoheptan-3-yl-4-methylbenzenesulfonamide hydrochloride, tlck, tlck hydrochloride PubChem CID: 73093 IUPAC Name: N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-4-methylbenzenesulfonamide;hydrochloride SMILES: [H+].[Cl-].CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCCCN)C(=O)CCl

CAS: 363-03-1 Molecular Formula: C12H8O2 Molecular Weight (g/mol): 184.19 MDL Number: MFCD00001599 InChI Key: RLQZIECDMISZHS-UHFFFAOYSA-N Synonym: p-benzoquinone, phenyl, phenyl-1,4-benzoquinone, 2-phenyl-p-benzoquinone, 2,5-cyclohexadiene-1,4-dione, 2-phenyl, p-benzoquinone, 2-phenyl, 2-phenylbenzoquinone, 2-phenyl-1,4-benzoquinone, phenylbenzoquinone, phenylquinone, phenyl-p-benzoquinone PubChem CID: 9688 IUPAC Name: 2-phenylcyclohexa-2,5-diene-1,4-dione SMILES: O=C1C=CC(=O)C(=C1)C1=CC=CC=C1

CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: 3-methoxy-4-hydroxybenzaldehyde, 4-hydroxy-m-anisaldehyde, lioxin, vanilline, 2-methoxy-4-formylphenol, p-vanillin, vanilla, vanillic aldehyde, vanillaldehyde, vanillin PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O

CAS: 111-30-8 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00007025 InChI Key: SXRSQZLOMIGNAQ-UHFFFAOYSA-N Synonym: glutaric aldehyde, aldesan, glutarol, sonacide, 1,5-pentanedial, glutardialdehyde, cidex, glutaric dialdehyde, glutaral, glutaraldehyde PubChem CID: 3485 ChEBI: CHEBI:64276 IUPAC Name: pentanedial SMILES: O=CCCCC=O

CAS: 504-02-9 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00001585 InChI Key: HJSLFCCWAKVHIW-UHFFFAOYSA-N Synonym: 1,3-cyclohexane dione, 1,3-benzenediol, dihydro, unii-6uk3d2bxjt, 1,3-cyclohexanone, resorcinol, dihydro, hydroresorcinol, 1,3 cyclohexanedione, 1,3-cyclohexandione, dihydroresorcinol, 1,3-cyclohexanedione PubChem CID: 10434 ChEBI: CHEBI:17766 IUPAC Name: cyclohexane-1,3-dione SMILES: C1CC(=O)CC(=O)C1

CAS: 139-85-5 Molecular Formula: C₇H₆O₃ Molecular Weight (g/mol): 138.12 MDL Number: MFCD00003370 InChI Key: IBGBGRVKPALMCQ-UHFFFAOYSA-N Synonym: unii-4pvp2hch4t, 1,2-dihydroxy-4-formylbenzene, 4-formyl-1,2-benzenediol, 3,4-dihydroxy-benzaldehyde, 4-formyl-1,2-dihydroxybenzene, 3,4-dihydroxybenzenecarbonal, benzaldehyde, 3,4-dihydroxy, protocatechuic aldehyde, rancinamycin iv, protocatechualdehyde PubChem CID: 8768 ChEBI: CHEBI:50205 IUPAC Name: 3,4-dihydroxybenzaldehyde SMILES: C1=CC(=C(C=C1C=O)O)O

CAS: 4312-99-6 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.199 MDL Number: MFCD00036558 InChI Key: KLTVSWGXIAYTHO-UHFFFAOYSA-N Synonym: octen-3-one, 1, n-pentyl vinyl ketone, 7lt7z4q9xr, fema no. 3515, 1-octene-3-one, unii-7lt7z4q9xr, pentyl vinyl ketone, amyl vinyl ketone, vinyl amyl ketone, 1-octen-3-one PubChem CID: 61346 IUPAC Name: oct-1-en-3-one SMILES: CCCCCC(=O)C=C

CAS: 5000-65-7 Molecular Formula: C₉H₉BrO₂ Molecular Weight (g/mol): 229.07 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 3-methoxyphenacylbromide, ccris 7998, bromomethyl 3-methoxyphenyl ketone, 3-methoxyphenacyl bromide, 2-bromo-1-3-methoxyphenyl ethan-1-one, 3-bromoacetyl anisole, 3'-methoxyphenacyl bromide, m-methoxyphenacyl bromide, 2-bromo-3'-methoxyacetophenone, 2-bromo-1-3-methoxyphenyl ethanone PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr

CAS: 9004-54-0 Molecular Formula: (C6H9O5)n(C6H10O5)m Molecular Weight (g/mol): 504.44 MDL Number: MFCD00130935 InChI Key: FZWBNHMXJMCXLU-UHFFFAOYNA-N Synonym: 2,3,4,5-tetrahydroxy-6-3,4,5-trihydroxy-6-3,4,5-trihydroxy-6-hydroxymethyl tetrahydropyran-2-yl oxymethyl tetrahydropyran-2-yl oxy-hexanal, 2,3,4,5-tetrahydroxy-6-3,4,5-trihydroxy-6-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxymethyl oxan-2-yl oxyhexanal, 2,3,4,5-tetrahydroxy-6-3,4,5-trihydroxy-6-3,4,5-trihydroxy-6-hydroxymethyl tetrahydro-2h-pyran-2-yl oxy methyl tetrahydro-2h-pyran-2-yl oxy hexanal, dextran, mw-86.000 aver., dextran PubChem CID: 4125253 IUPAC Name: Dextran SMILES: O[C@@H]1[C@@H](O)[C@@H](-*)O[C@H](CO[C@H]2O[C@H](CO-*)[C@@H](O)[C@H](O-*)[C@H]2O)[C@H]1O

CAS: 88-15-3 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005442 InChI Key: WYJOVVXUZNRJQY-UHFFFAOYSA-N Synonym: 2-thienyl methyl ketone, ketone, methyl 2-thienyl, 2-acetyl thiophene, ethanone, 1-2-thienyl, 2-acetothiophene, 2-acetothienone, methyl 2-thienyl ketone, 1-thiophen-2-yl-ethanone, 1-2-thienyl ethanone, 2-acetylthiophene PubChem CID: 6920 IUPAC Name: 1-thiophen-2-ylethanone SMILES: CC(=O)C1=CC=CS1

CAS: 106-51-4 Molecular Formula: C₆H₄O₂ Molecular Weight (g/mol): 108.1 MDL Number: MFCD00001591 InChI Key: AZQWKYJCGOJGHM-UHFFFAOYSA-N Synonym: 1,4-benzoquine, para-quinone, cyclohexadienedione, 2,5-cyclohexadiene-1,4-dione, chinone, p-quinone, 1,4-benzoquinone, quinone, benzoquinone, p-benzoquinone PubChem CID: 4650 ChEBI: CHEBI:16509 IUPAC Name: cyclohexa-2,5-diene-1,4-dione SMILES: C1=CC(=O)C=CC1=O

CAS: 123-38-6 Molecular Formula: C₃H₆O Molecular Weight (g/mol): 58.08 InChI Key: NBBJYMSMWIIQGU-UHFFFAOYSA-N Synonym: aldehyde propionique, propylic aldehyde, propylaldehyde, methylacetaldehyde, n-propanal, propionic aldehyde, propional, propaldehyde, propanaldehyde, propionaldehyde PubChem CID: 527 ChEBI: CHEBI:17153 IUPAC Name: propanal SMILES: CCC=O