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Depiction
Upstream Precursor
Agn-PC-0bxxce
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCN3C(=O)C=CC3=O)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCN(C(=O)C=CC(=O)O)Cl)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCO)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCN3C(=O)C(C(C3=O)O)Cl)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCNC(=O)C(C(C(=O)O)O)Cl)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCNC(C(C(C(=O)O)Cl)O)=O)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CCNC(=O)C=CC(=O)O)NC(=O)N2
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1=O)CCCCC(=O)NCCOCCOCCNC(=O)CCN3C(=O)C(C(C3=O)O)Cl)N…
Depth 2
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCNC(=O)CC[N+]3(C(=O)C(C(C3=O)O)Cl…
Depth 1
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Upstream Precursor
C1C2C(C(S1=O)CCCCC(=O)NCCOCCOCCNC(=O)CCN3C(=O)C=CC3=O)NC(=O)N2
Depth 2
Depiction
Product
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Acetic Acid
CC(=O)O
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 3
Depiction
Downstream Successor
Chloroacetate
[O-]C(=O)CCl
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Glycolaldehyde
C(C=O)O
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 3
Depiction
Downstream Successor
Acetamide
NC(=O)C
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Glycine
C(CN)(O)=O
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Ethylene Glycol
C(CO)O
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 1
Depiction
Downstream Successor
Ethanolamine
NCCO
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 1
Depiction
Downstream Successor
Aminoacetaldehyde
NCC=O
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Diethylene Glycol
C(CO)OCCO
Depiction
Precursor
Poly(oxy-1,2-ethanediyl), alpha-(2-aminoethyl)-omega-(2-((5-((3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)amino)ethoxy)-
C1C2C(C(S1)CCCCC(=O)NCCOCCOCCN)NC(=O)N2
Depth 2
Depiction
Downstream Successor
Acetaldehyde, 2-(2-hydroxyethoxy)-
OCCOCC=O
No Original Precursors

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No Dead-Ends

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