Search More · GCI-TPs

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Upstream Precursor

JICJBGPOMZQUBB-UHFFFAOYSA-N

Tianeptine

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)NCCCCCCC(=O)O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

FHICZIHQHGRZLE-UHFFFAOYSA-N

3,11-Dichloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepine 5,5-dioxide

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)Cl

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

KBRSJPHSCOAFDR-UHFFFAOYSA-N

3-Chloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepin-11-ol 5,5-dioxide

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)Cl)O

Depth 1

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

STSVGILHZGZNJS-UHFFFAOYSA-N

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)O)NCCCCCCC(=O)O

Depth 1

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

BXUDPVQWZDPUOS-UHFFFAOYSA-N

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=CC=C3)NCCCCC(O)=O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

JMFDJSZIOWLQSP-UHFFFAOYSA-N

7-[(6-methyl-5,5-dioxo-11H-benzo[c][1,2]benzothiazepin-11-yl)amino]heptanoic acid

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=CC=C3)NCCCCCCC(=O)O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

MJXNZHSUXKRYED-UHFFFAOYSA-N

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)O)NCCCCC(O)=O

Depth 1

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

CTBYLUIZYSAENH-UHFFFAOYSA-N

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C(=C(C=C3)O)Cl)NCCCCCCC(=O)O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

PQKACIOOQKXJLL-UHFFFAOYSA-N

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C(=C3)Cl)O)NCCCCCCC(=O)O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Upstream Precursor

BYPYVXCZPZLHBO-UHFFFAOYSA-N

Tianeptine Metabolite MC5

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)NCCCCC(O)=O

Depth 2

Product

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

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Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 2

Downstream Successor

OKKJLVBELUTLKV-UHFFFAOYSA-N

Methanol

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 3

Downstream Successor

VRHYNNZLSGIOBW-UHFFFAOYSA-N

CNC1=C(C=CC=C1)C(=O)C2=CC=C(C=C2)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 2

Downstream Successor

ISQVROXEDZSEAG-UHFFFAOYSA-M

CNC1=CC=CC=C1C(=O)C2=C(S(=O)(=O)[O-])C=C(C=C2)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 1

Downstream Successor

HEUSGSSHFMQZIR-UHFFFAOYSA-M

CNc1ccccc1C(c2c(S(=O)(=O)[O-])cc(cc2)O)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 3

Downstream Successor

TZYYAKSMDRBVOJ-UHFFFAOYSA-N

CN1C2=CC(=C(C=C2C(=O)C3=C(S1(=O)=O)C=C(C=C3)O)O)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 3

Downstream Successor

BCFAPYLPNKTKNT-UHFFFAOYSA-N

CN1C2=C(C(=CC=C2C(=O)C3=C(S1(=O)=O)C=C(C=C3)O)O)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 1

Downstream Successor

VPBKXKPCTUHXIA-UHFFFAOYSA-N

3-Hydroxy-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-one

CN1C2=CC=CC=C2C(=O)C3=C(S1(=O)=O)C=C(C=C3)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 2

Downstream Successor

BYNRKPRDWZCUPX-UHFFFAOYSA-N

CN1c2cc(c(cc2C(c3c(S1(=O)=O)cc(cc3)O)O)O)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 2

Downstream Successor

PWKLYJJCUXNGHY-UHFFFAOYSA-N

CN1C2=CC(=CC=C2C(=O)C3=C(S1(=O)=O)C=C(C=C3)O)O

Precursor

HDZNOUJFMXXTRF-UHFFFAOYSA-N

6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepine-3,11-diol

CN1c2ccccc2C(c3c(S1(=O)=O)cc(cc3)O)O

Depth 2

Downstream Successor

VRZAUTQMAANFDH-UHFFFAOYSA-N

CN1c2c(c(ccc2C(c3c(S1(=O)=O)cc(cc3)O)O)O)O

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No Dead-Ends

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