N(2)-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321)

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CHEBI:145321 - N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine

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ChEBI ID	CHEBI:145321
ChEBI Name	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine
Stars
ASCII Name	N(2)-[(2E)-3-methylhex-2-enoyl]-L-glutamine
Definition	An N²-acyl-L-glutamine resulting from the formal condensation of the alpha-amino group of L-glutamine with the carboxy group of (2E)-3-methylhex-2-enoic acid.
Last Modified	6 November 2019
Submitter	Gareth Owen
Downloads	Molfile

Formula	C12H20N2O4
Net Charge	0
Average Mass	256.302
Monoisotopic Mass	256.14231
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)/b8-7+/t9-/m0/s1
InChIKey	AUBGCRXOZPJJJG-FLOXNTQESA-N

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321) is a N²-acyl-L-glutamine (CHEBI:17008)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321) is a primary carboxamide (CHEBI:140324)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321) is a secondary carboxamide (CHEBI:140325)
	N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321) is conjugate acid of N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557)
Incoming Relation(s)
Incoming Relation(s)	N²-[(2E)-3-methylhex-2-enoyl]-L-glutaminate (CHEBI:143557) is conjugate base of N²-[(2E)-3-methylhex-2-enoyl]-L-glutamine (CHEBI:145321)

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

Synonym	Source
N^α-[(2E)-3-methylhex-2-enoyl]-L-glutamine	MetaCyc

Manual Xrefs	Databases
CPD-21074	MetaCyc

Citations