3,6-Dimethyl-2,5-piperazinedione; (3RS,6SR)-form, N-(2E,4E-Hexadienoyl) 

AlkaPlorer ID: AK296667

Synonym: Nigragilline

IUPAC Name: None

Structure

SMILES: C/C=C\C=C\C(=O)N1CC(C)N(C)CC1C

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InChI: InChI=1S/C13H22N2O/c1-5-6-7-8-13(16)15-10-11(2)14(4)9-12(15)3/h5-8,11-12H,9-10H2,1-4H3/b6-5-,8-7+

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InChIKey: DVCNHRTYSUTLOS-IGTJQSIKSA-N

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Reference

CAS: 24779-38-2

Properties Information

Molecule Weight: 222.332

TPSA: 23.550000000000004

MolLogP: 1.6697000000000002

Number of H-Donors: 0

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information