Graphs show a maximum of 100 compounds. Use downloads for complete results.
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
10 steps
Depiction
Dead-End Product
OKKJLVBELUTLKV-UHFFFAOYSA-N
Methanol
CO
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
6 steps
Depiction
Dead-End Product
BDAGIHXWWSANSR-UHFFFAOYSA-N
Formic Acid
OC=O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
6 steps
Depiction
Dead-End Product
BVKZGUZCCUSVTD-UHFFFAOYSA-N
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
6 steps
Depiction
Dead-End Product
MUBZPKHOEPUJKR-UHFFFAOYSA-N
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
10 steps
Depiction
Dead-End Product
CKFGINPQOCXMAZ-UHFFFAOYSA-N
Methanediol
C(O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
10 steps
Depiction
Dead-End Product
VNWKTOKETHGBQD-UHFFFAOYSA-N
Methane
C
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
8 steps
Depiction
Dead-End Product
HEPCJCVNHBXRBO-UHFFFAOYSA-N
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
14 steps
Depiction
Dead-End Product
RBBOAWUPWQANPY-UHFFFAOYSA-N
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
14 steps
Depiction
Dead-End Product
YPOPNBBFFROUGR-UHFFFAOYSA-N
But-1-ene-1,1,4-triol
C(CC=C(O)O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
19 steps
Depiction
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.

Depiction
Upstream Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
NRGDCPDGFZEUSG-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S3=O)C…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
NRGDCPDGFZEUSG-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S3=O)C…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
HAUOYFBINMRVPQ-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1=O)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S3)C…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
HAUOYFBINMRVPQ-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1=O)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S3)C…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
UIFKYTCUBTWHOY-UHFFFAOYSA-O
CCC(=CC1N(C2=C([S+]1Cl)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
NHRDJZRWABHYHV-UHFFFAOYSA-O
CCC(=CC1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C([S+]3C…
Abiotic
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Upstream Precursor
MWIPXEVNLIFNJR-UHFFFAOYSA-N
CCC(=CC1[N+](C2=C(S1)C=CC(=C2)Cl)(CCCS(=O)(=O)O)[O-])C=C3N(C4…
Environmental
Depiction
Product
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…

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

Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
OAKURXIZZOAYBC-UHFFFAOYSA-N
3-Oxopropanoic acid
OC(=O)CC=O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Abiotic
Depiction
Downstream Successor
CZJYONJVHLMKCY-UHFFFAOYSA-N
3-Sulfopropionaldehyde
C(C=O)CS(=O)(=O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
CZJYONJVHLMKCY-UHFFFAOYSA-N
3-Sulfopropionaldehyde
C(C=O)CS(=O)(=O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
CZJYONJVHLMKCY-UHFFFAOYSA-N
3-Sulfopropionaldehyde
C(C=O)CS(=O)(=O)O
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Abiotic
Depiction
Downstream Successor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
MDTFLMPSGAZAGS-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1)C=CC(=C2)O)CCCS(=O)(=O)O)C=C3N(C4=C(S3)C=CC…
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
ZAPOBFBPBIZAHN-UHFFFAOYSA-N
CCC(=CC1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)C=C3N(C4=C(S3)C=C…
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
RXDFGGMZEPVUCO-UHFFFAOYSA-N
CCC(=CC(N(C1=C(S)C=CC(=C1)Cl)CCCS(=O)(=O)O)=O)C=C2N(C3=C(S2)C…
Depiction
Precursor
BVDIJGJGMDUCHA-AZNIMHGRSA-N
3-[2-[(E)-2-[(Z)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-2H-1,3-benzothiazol-1-ium-3-yl]propane-1-sulfonate
CC/C(=C\C1N(C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S…
Environmental
Depiction
Downstream Successor
YXPZBECSTQETQV-UHFFFAOYSA-N
CCC(=CC(N(C1=C(S)C=CC(=C1)Cl)CCCS(=O)(=O)O)O)C=C2N(C3=C(S2)C=…

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

No Original Precursors

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