3-Methyl-6-(2-methylpropylidene)-2,5-piperazinedione; (3ξ,6ξ)-form

AlkaPlorer ID: AK306151

Synonym: Brevibactin C

IUPAC Name: (6Z)-3-methyl-6-(2-methylpropylidene)piperazine-2,5-dione

Structure

SMILES: CC(C)/C=C1\NC(=O)C(C)NC1=O

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InChI: InChI=1S/C9H14N2O2/c1-5(2)4-7-9(13)10-6(3)8(12)11-7/h4-6H,1-3H3,(H,10,13)(H,11,12)/b7-4-

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InChIKey: CMAZZORFNVWTEF-DAXSKMNVSA-N

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Reference

PubChem CID: 10726113

CAS: 1802672-81-6

Source

Properties Information

Molecule Weight: 182.223

TPSA: 58.2

MolLogP: 0.1607999999999999

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information