2Z-Dodecenedioic acid (CHEBI:169695)

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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	2Z-Dodecenedioic acid

ChEBI ID	CHEBI:169695

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H20O4

Net Charge

Average Mass

228.288

Monoisotopic Mass

228.13616

InChI

InChI=1S/C12H20O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h7,9H,1-6,8,10H2,(H,13,14)(H,15,16)/b9-7-

InChIKey

MAZWDMBCPDUFDJ-CLFYSBASSA-N

SMILES

OC(=O)CCCCCCCC/C=C\C(O)=O

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	2Z-Dodecenedioic acid (CHEBI:169695) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

(Z)-dodec-2-enedioic acid

Registry Number	Type	Source
6556-35-0	CAS Registry Number	ChemIDplus