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Depiction
Upstream Precursor
CBVCZFGXHXORBI-UHFFFAOYSA-O
CC(C)(C)NC(=O)C1C[NH+](CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=C…
Depth 1
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depiction
Upstream Precursor
GAHFBUPREATHEC-UHFFFAOYSA-N
CC(C)(C)NC(=O)C1CN(CC[N+]1(CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=C…
Depth 2
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depiction
Upstream Precursor
QBOIZPYZXDAURQ-UHFFFAOYSA-N
CC(C)(C)NC(=O)C1CN(CC[N+]1(CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=C…
Depth 1
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depiction
Upstream Precursor
SQBPJSPXOLQQPD-UHFFFAOYSA-N
CC(C)(C)NC(=O)C1C[N+](CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC…
Depth 2
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depiction
Upstream Precursor
DTNMKHCZCRCNMM-UHFFFAOYSA-N
CC(C)(C)NC(=O)C1C[N+](CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC…
Depth 1
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depiction
Upstream Precursor
BKHDLRMSKAUADY-UHFFFAOYSA-N
CC(C)(C)NC(=O)C1C[N+](CC[N+]1(CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC…
Depth 3
Depiction
Product
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…

Previewing top 6 entries. If you want the full results, please use the download button above.

Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 2
Depiction
Downstream Successor
WPYMKLBDIGXBTP-UHFFFAOYSA-N
Benzoic Acid
C1=CC(=CC=C1)C(O)=O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 1
Depiction
Downstream Successor
YBRBMKDOPFTVDT-UHFFFAOYSA-N
Tert-Butylamine
NC(C)(C)C
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 2
Depiction
Downstream Successor
FJCFFCXMEXZEIM-UHFFFAOYSA-N
Oxiniacic Acid
c1cc(c[n+](c1)[O-])C(=O)O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 2
Depiction
Downstream Successor
XMIIGOLPHOKFCH-UHFFFAOYSA-N
Benzenepropanoic acid
C(CC1=CC=CC=C1)C(=O)O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 2
Depiction
Downstream Successor
LUQZKEZPFQRRRK-UHFFFAOYSA-N
2-Methyl-2-nitrosopropane
CC(C)(C)N=O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 1
Depiction
Downstream Successor
LOPKSXMQWBYUOI-UHFFFAOYSA-N
1-Amino-2-indanol
C1C(C(c2ccccc21)N)O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 1
Depiction
Downstream Successor
YKXXBEOXRPZVCC-UHFFFAOYSA-N
1,2-Indanediol
C1C2=CC=CC=C2C(C1O)O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 2
Depiction
Downstream Successor
CBTVGIZVANVGBH-UHFFFAOYSA-N
2-Amino-2-methyl-1-propanol
CC(CO)(N)C
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 1
Depiction
Downstream Successor
XEZMWIFCFZCFPJ-UHFFFAOYSA-N
1H-Inden-1-one, 2,3-dihydro-2-hydroxy-
C1C(C(C2=CC=CC=C21)=O)O
Depiction
Precursor
COILGLLTSZXSAH-UHFFFAOYSA-N
1-[4-benzyl-2-hydroxy-5-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-5-oxopentyl]-N-tert-butyl-4-[(1-oxidopyridin-1-ium-3-yl)methyl]piperazine-2-carboxamide
CC(C)(C)NC(=O)C1CN(CCN1CC(CC(CC2=CC=CC=C2)C(=O)NC3C(CC4=CC=CC…
Depth 1
Depiction
Downstream Successor
LNYJHQOHEHEMOO-UHFFFAOYSA-N
3-Pyridinecarboxaldehyde, 1-oxide
c1cc(c[n+](c1)[O-])C=O

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No Original Precursors

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No Dead-Ends

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