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Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
1 step
Depiction
Dead-End Product
Methanol
CO
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
2 steps
Depiction
Dead-End Product
Formic Acid
OC=O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
4 steps
Depiction
Dead-End Product
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
2 steps
Depiction
Dead-End Product
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
10 steps
Depiction
Dead-End Product
Methanediol
C(O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
10 steps
Depiction
Dead-End Product
Methane
C
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
6 steps
Depiction
Dead-End Product
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
13 steps
Depiction
Dead-End Product
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
13 steps
Depiction
Dead-End Product
But-1-ene-1,1,4-triol
C(CC=C(O)O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
4 steps
Depiction
Dead-End Product
CID 22568690
C([N+](=O)[O-])([O-])=O
Depiction
Upstream Precursor
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 1
Depiction
Product
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 1
Depiction
Downstream Successor
Methanol
CO
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
Formic Acid
OC=O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
4-Aminophenol
c1cc(ccc1O)N
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 1
Depiction
Downstream Successor
5-Aminosalicylic Acid
C1=C(C(=CC(=C1)N)C(O)=O)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
P-Phenylenediamine
Nc1ccc(cc1)N
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
4-Aminocatechol
OC1=C(C=CC(=C1)N)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
3-Aminobenzoic Acid
C(=O)(c1cc(ccc1)N)O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
C(C=CC(=CC(O)=O)N)(O)=O
Depiction
Precursor
5-[[4-[[3-[[4-[(3-Carboxy-4-hydroxyphenyl)diazenyl]phenyl]carbamoylamino]benzoyl]amino]-5-methoxy-2-methylphenyl]diazenyl]-2-hydroxy-3-sulfobenzoic acid
CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)S(=O)(=O)O)O)C(=O)O)OC)NC(C3=…
Depth 2
Depiction
Downstream Successor
5-Amino-2,3-dihydroxybenzoic acid
C(=O)(c1c(c(cc(c1)N)O)O)O
No Original Precursors

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