Cyclo-(D-Pipecolinyl-L-isoleucine)

AlkaPlorer ID: AK056764

Synonym: None

IUPAC Name: (3S,9aR)-3-[(2S)-butan-2-yl]-3,6,7,8,9,9a-hexahydro-2H-pyrido[1,2-a]pyrazine-1,4-dione

Structure

SMILES: CC[C@H](C)[C@@H]1N=C(O)[C@H]2CCCCN2C1=O

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InChI: InChI=1S/C12H20N2O2/c1-3-8(2)10-12(16)14-7-5-4-6-9(14)11(15)13-10/h8-10H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m0/s1

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InChIKey: NUAAKGTVBAGZNF-AEJSXWLSSA-N

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Properties Information

Molecule Weight: 224.30399999999992

TPSA: 52.900000000000006

MolLogP: 1.7523000000000002

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information