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Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
1 step
Depiction
Dead-End Product
OKKJLVBELUTLKV-UHFFFAOYSA-N
Methanol
CO
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
1 step
Depiction
Dead-End Product
BDAGIHXWWSANSR-UHFFFAOYSA-N
Formic Acid
OC=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
4 steps
Depiction
Dead-End Product
BVKZGUZCCUSVTD-UHFFFAOYSA-N
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
7 steps
Depiction
Dead-End Product
MUBZPKHOEPUJKR-UHFFFAOYSA-N
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
10 steps
Depiction
Dead-End Product
CKFGINPQOCXMAZ-UHFFFAOYSA-N
Methanediol
C(O)O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
10 steps
Depiction
Dead-End Product
VNWKTOKETHGBQD-UHFFFAOYSA-N
Methane
C
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
13 steps
Depiction
Dead-End Product
LJDZFAPLPVPTBD-UHFFFAOYSA-M
CID 22568690
C([N+](=O)[O-])([O-])=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
11 steps
Depiction
Dead-End Product
HJEBWCDVXVPBRC-UHFFFAOYSA-N
C(=C(C(=C(O)C(=O)O)O)O)([N+](=O)[O-])C(O)=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
1 step
Depiction
Dead-End Product
CURLTUGMZLYLDI-UHFFFAOYSA-N
Carbon Dioxide
C(=O)=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
10 steps
Depiction
Dead-End Product
XMDUJYSZCSKMPL-UHFFFAOYSA-N
CC(C(=C([N+](=O)[O-])C(=O)O)O)=C(O)C(O)=O

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Depiction
Upstream Precursor
DUQWXXBQLZXFAI-UHFFFAOYSA-N
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C(=C3C=C(C=CC3=C2O)NC4=NC…
Depth 1
Depiction
Product
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…

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Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 1
Depiction
Downstream Successor
OKKJLVBELUTLKV-UHFFFAOYSA-N
Methanol
CO
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 1
Depiction
Downstream Successor
BDAGIHXWWSANSR-UHFFFAOYSA-N
Formic Acid
OC=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 3
Depiction
Downstream Successor
QUSNBJAOOMFDIB-UHFFFAOYSA-N
Ethylamine
NCC
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 1
Depiction
Downstream Successor
CURLTUGMZLYLDI-UHFFFAOYSA-N
Carbon Dioxide
C(=O)=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 2
Depiction
Downstream Successor
QNAYBMKLOCPYGJ-UHFFFAOYSA-O
Alaninium
[NH3+]C(C)C(=O)O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 3
Depiction
Downstream Successor
MTCFGRXMJLQNBG-UHFFFAOYSA-N
DL-Serine
C(C(N)CO)(O)=O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 2
Depiction
Downstream Successor
QPMCUNAXNMSGTK-UHFFFAOYSA-N
Alaninal
NC(C=O)C
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 1
Depiction
Downstream Successor
IIDAJRNSZSFFCB-UHFFFAOYSA-N
4-Amino-5-methoxy-2-methylbenzenesulfonamide
Cc1cc(c(cc1S(=N)(=O)O)OC)N
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 3
Depiction
Downstream Successor
LSKLJCIBJBAMNG-UHFFFAOYSA-N
4-Amino-5-hydroxy-2-methylbenzenesulfonic acid
CC1=C(C=C(C(=C1)N)O)S(=O)(=O)O
Depiction
Precursor
DBIFMXVBXLDEPF-UHFFFAOYSA-N
7-[[4-[(2-Amino-1-formyloxypropan-2-yl)amino]-6-(2-azaniumylpropylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-methoxy-5-methyl-4-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonate
CC1=CC(=C(C=C1S(=N)(=O)O)OC)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(…
Depth 2
Depiction
Downstream Successor
XMRGRUFGOFJORY-UHFFFAOYSA-N
4-Amino-5-hydroxy-2-methylbenzenesulfonamide
CC1=C(C=C(C(=C1)N)O)S(=O)(=O)N

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No Original Precursors

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