CHEBI:182344 - 2-Methylidene-3-(6-oxalooxyhexyl)butanedioic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Methylidene-3-(6-oxalooxyhexyl)butanedioic acid
ChEBI ID CHEBI:182344
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H18O8
Net Charge 0
Average Mass 302.279
Monoisotopic Mass 302.10017
InChI InChI=1S/C13H18O8/c1-8(10(14)15)9(11(16)17)6-4-2-3-5-7-21-13(20)12(18)19/h9H,1-7H2,(H,14,15)(H,16,17)(H,18,19)
InChIKey CLFOWTUGPBWLGH-UHFFFAOYSA-N
SMILES O(CCCCCCC(C(C(O)=O)=C)C(O)=O)C(=O)C(O)=O
ChEBI Ontology
Outgoing 2-Methylidene-3-(6-oxalooxyhexyl)butanedioic acid (CHEBI:182344) has functional parent tetracarboxylic acid (CHEBI:35742)
2-Methylidene-3-(6-oxalooxyhexyl)butanedioic acid (CHEBI:182344) is a organooxygen compound (CHEBI:36963)
IUPAC Name
2-methylidene-3-(6-oxalooxyhexyl)butanedioic acid
Manual Xref Database
22369693 ChemSpider
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