4,5-dehydropipecolic acid (Q27982916)

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group of stereoisomers

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Language	Label	Description	Also known as
English	4,5-dehydropipecolic acid	group of stereoisomers

Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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chemical structure

1,2,3,6-tetrahydropyridine-2-carboxylic acid.svg
116 × 95; 5 KB

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mass

127.063328528 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₆H₉NO₂

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canonical SMILES

O=C(O)C1NCC=CC1

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Identifiers

InChI

InChI=1S/C6H9NO2/c8-6(9)5-3-1-2-4-7-5/h1-2,5,7H,3-4H2,(H,8,9)

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InChIKey

YCQPUTODZKESPK-UHFFFAOYSA-N

1 reference

stated in

ChemIDplus

title

4,5-Dehydropipecolic acid (English)

retrieved

9 December 2016

reference URL

https://chem.nlm.nih.gov/chemidplus/rn/498-98-6

CAS Registry Number

498-98-6

2 references

stated in

ChemIDplus

title

4,5-Dehydropipecolic acid (English)

retrieved

9 December 2016

reference URL

https://chem.nlm.nih.gov/chemidplus/rn/498-98-6

InChIKey

YCQPUTODZKESPK-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=498-98-6

PubChem CID

557590

1 reference

matched by identifier from

InChIKey

InChIKey

YCQPUTODZKESPK-UHFFFAOYSA-N

DSSTox substance ID

DTXSID20964413

1 reference

matched by identifier from

InChIKey

InChIKey

YCQPUTODZKESPK-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID10964109

0 references

Human Metabolome Database ID

HMDB0302856

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

YCQPUTODZKESPK-UHFFFAOYSA-N

 

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