3-sulfinylpyruvic acid (Q27105488)

b-sulfinyl pyruvate (English)

5 October 2016

chemical formula

C₃H₄O₅S

1 reference

b-sulfinyl pyruvate (English)

5 October 2016

canonical SMILES

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

1 reference

Recon 2.2: from reconstruction to model of human metabolism

b-sulfinyl pyruvate (English)

5 October 2016

2 references

stated in

A community-driven global reconstruction of human metabolism.

Identifiers

InChI

InChI=1S/C3H4O5S/c4-2(3(5)6)1-9(7)8/h1H2,(H,5,6)(H,7,8)

1 reference

b-sulfinyl pyruvate (English)

JXYLQEMXCAAMOL-UHFFFAOYSA-N

5 October 2016

InChIKey

2 references

b-sulfinyl pyruvate (English)

CAS (formerly Chemical Abstracts Service)

5 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

88947-38-0

1 reference

stated in

25 January 2022

1 reference

b-Sulfinyl pyruvate (English)

5 October 2016

1 reference

b-sulfinyl pyruvate (English)

5 October 2016

ChEBI ID

1665

mapping relation type

2 references

3-sulfinylpyruvic acid (English)

matched by identifier from

5 October 2016

International Chemical Identifier

InChI

InChI=1S/C3H4O5S/c4-2(3(5)6)1-9(7)8/h1H2,(H,5,6)(H,7,8)

1 reference

Human Metabolome Database ID

HMDB0002332

0 references

HMDB0001405

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JXYLQEMXCAAMOL-UHFFFAOYSA-N

1 reference

3-sulfinylpyruvic acid (English)