Graphs show a maximum of 100 compounds. Use downloads for complete results.
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
4 steps
Depiction
Dead-End Product
BVKZGUZCCUSVTD-UHFFFAOYSA-N
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
5 steps
Depiction
Dead-End Product
MUBZPKHOEPUJKR-UHFFFAOYSA-N
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
7 steps
Depiction
Dead-End Product
HEPCJCVNHBXRBO-UHFFFAOYSA-N
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
12 steps
Depiction
Dead-End Product
RBBOAWUPWQANPY-UHFFFAOYSA-N
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
12 steps
Depiction
Dead-End Product
YPOPNBBFFROUGR-UHFFFAOYSA-N
But-1-ene-1,1,4-triol
C(CC=C(O)O)O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
5 steps
Depiction
Dead-End Product
LJDZFAPLPVPTBD-UHFFFAOYSA-M
CID 22568690
C([N+](=O)[O-])([O-])=O

Previewing top 10 entries. If you want the full results, please use the download button above.

Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
PriorBiotransformation
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
PriorBiotransformation
Depiction
Downstream Successor
LGYNIFWIKSEESD-UHFFFAOYSA-N
2-Ethylhexanal
O=CC(CC)CCCC
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
LGYNIFWIKSEESD-UHFFFAOYSA-N
2-Ethylhexanal
O=CC(CC)CCCC
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
KPUIMIXJCTZXCI-UHFFFAOYSA-N
5-amino-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carbonitrile
Cc1c(c(=O)[nH]c(c1C#N)O)N
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
ZZNAYFWAXZJITH-UHFFFAOYSA-N
Benzoic acid, 4-amino-3-nitro-
C(C1=CC(=C(C=C1)N)[N+](=O)[O-])(O)=O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
PriorBiotransformation
Depiction
Downstream Successor
ZZNAYFWAXZJITH-UHFFFAOYSA-N
Benzoic acid, 4-amino-3-nitro-
C(C1=CC(=C(C=C1)N)[N+](=O)[O-])(O)=O
Depiction
Precursor
WFYFUPXDOJPGEH-UHFFFAOYSA-N
2-Ethylhexyl 4-[(5-cyano-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinyl)diazenyl]-3-nitrobenzoate
CCCCC(CC)COC(=O)C1=CC(=C(C=C1)N=NC2=C(C(=C(N(C2=O)C)O)C#N)C)[…
Abiotic
Depiction
Downstream Successor
AJJXNQWONANIBW-UHFFFAOYSA-N
5-Amino-2-hydroxy-1,4-dimethyl-6-oxopyridine-3-carbonitrile
Cc1c(c(=O)n(c(c1C#N)O)C)N

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No Original Precursors

No entries were found for this section with the current query and depth.

No All Precursors

No entries were found for this section with the current query and depth.

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