N(2)-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557)

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CHEBI:143557 - N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate

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ChEBI ID	CHEBI:143557
ChEBI Name	N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate
Stars
ASCII Name	N(2)-[(2E)-3-methylhex-2-enoyl]-L-glutaminate
Definition	An N²-acyl-L-glutaminate resulting from the deprotonation of the carboxy group of N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine. The major species at pH 7.3.
Last Modified	22 June 2021
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C12H19N2O4
Net Charge	-1
Average Mass	255.294
Monoisotopic Mass	255.13503
SMILES	CCC/C(C)=C/C(=O)N[C@@H](CCC(N)=O)C(=O)[O-]
InChI	InChI=1S/C12H20N2O4/c1-3-4-8(2)7-11(16)14-9(12(17)18)5-6-10(13)15/h7,9H,3-6H2,1-2H3,(H2,13,15)(H,14,16)(H,17,18)/p-1/b8-7+/t9-/m0/s1
InChIKey	AUBGCRXOZPJJJG-FLOXNTQESA-M

ChEBI Ontology

Outgoing Relation(s)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557) is a N-(fatty acyl)-L-glutamine(1−) (CHEBI:149743)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557) is a N²-acyl-L-glutaminate (CHEBI:87584)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557) is conjugate base of N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321)
Incoming Relation(s)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321) is conjugate acid of N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557)

IUPAC Name
N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate

UniProt Name	Source
N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate	UniProt

Manual Xrefs	Databases
CPD-21074	MetaCyc

Citations