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Precursor

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

1 step

Dead-End Product

OKKJLVBELUTLKV-UHFFFAOYSA-N

Methanol

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

3 steps

Dead-End Product

BDAGIHXWWSANSR-UHFFFAOYSA-N

Formic Acid

OC=O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

7 steps

Dead-End Product

BVKZGUZCCUSVTD-UHFFFAOYSA-N

Carbonic Acid

C(=O)(O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

5 steps

Dead-End Product

MUBZPKHOEPUJKR-UHFFFAOYSA-N

Oxalic Acid

C(=O)(C(O)=O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

11 steps

Dead-End Product

CKFGINPQOCXMAZ-UHFFFAOYSA-N

Methanediol

C(O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

11 steps

Dead-End Product

VNWKTOKETHGBQD-UHFFFAOYSA-N

Methane

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

7 steps

Dead-End Product

HEPCJCVNHBXRBO-UHFFFAOYSA-N

Succinyl-carboxylic acid

C(CCC(=O)C(=O)O)(=O)C(O)=O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

13 steps

Dead-End Product

RBBOAWUPWQANPY-UHFFFAOYSA-N

1,2,4-Butantriol Alkohol

C(CC(C(O)O)O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

13 steps

Dead-End Product

YPOPNBBFFROUGR-UHFFFAOYSA-N

But-1-ene-1,1,4-triol

C(CC=C(O)O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

12 steps

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.

Upstream Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Upstream Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Upstream Precursor

SMULBEDICYPWHE-UHFFFAOYSA-N

COC1=CC=C(C=C1)COC(=O)C2=C(CS(C3N2C(=O)C3NC(=O)CC4=CC=CC=C4)=O)CCl

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Upstream Precursor

SMULBEDICYPWHE-UHFFFAOYSA-N

COC1=CC=C(C=C1)COC(=O)C2=C(CS(C3N2C(=O)C3NC(=O)CC4=CC=CC=C4)=O)CCl

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Upstream Precursor

XZHKUJNSEBFQNF-UHFFFAOYSA-O

COC1=CC=C(C=C1)COC(=O)C2=C(C[S+](C3N2C(=O)C3NC(=O)CC4=CC=CC=C…

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Upstream Precursor

SSQZJBJGFJJFMI-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-5,5,8-trioxo-7-[(2-phenylacetyl)amino]-5lambda6-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CS(C3N2C(=O)C3NC(=O)CC4=CC=CC=C4)(…

Abiotic

Product

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

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

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

OKKJLVBELUTLKV-UHFFFAOYSA-N

Methanol

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

HUMNYLRZRPPJDN-UHFFFAOYSA-N

Benzaldehyde

c1cccc(c1)C=O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

PriorBiotransformation

Downstream Successor

BVJSUAQZOZWCKN-UHFFFAOYSA-N

4-Hydroxybenzyl Alcohol

OCC1=CC=C(C=C1)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

BVJSUAQZOZWCKN-UHFFFAOYSA-N

4-Hydroxybenzyl Alcohol

OCC1=CC=C(C=C1)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

WLJVXDMOQOGPHL-UHFFFAOYSA-N

Phenylacetic Acid

C(CC1=CC=CC=C1)(O)=O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

PriorBiotransformation

Downstream Successor

MSHFRERJPWKJFX-UHFFFAOYSA-N

4-Methoxybenzyl alcohol

COc1ccc(cc1)CO

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

MSHFRERJPWKJFX-UHFFFAOYSA-N

4-Methoxybenzyl alcohol

COc1ccc(cc1)CO

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

CFFZDZCDUFSOFZ-UHFFFAOYSA-N

Dopac

C1=C(C(=CC(=C1)CC(=O)O)O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Abiotic

Downstream Successor

CIPQGGYPCPIDBB-UHFFFAOYSA-N

3-Methyl-8-oxo-7-[(phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SC1)C(=O)O

Precursor

KFCMZNUGNLCSJQ-UHFFFAOYSA-N

(4-Methoxyphenyl)methyl 3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

PriorBiotransformation

Downstream Successor

CIPQGGYPCPIDBB-UHFFFAOYSA-N

3-Methyl-8-oxo-7-[(phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SC1)C(=O)O

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

No Original Precursors

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