3-imino-1,2,4-oxadiazepane-5-carboxylic acid

AlkaPlorer ID: AK319579

Synonym: None

IUPAC Name: (5S)-3-amino-2,5,6,7-tetrahydro-1,2,4-oxadiazepine-5-carboxylic acid

Structure

SMILES: N=C1NOCC[C@@H](C(=O)O)N1

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InChI: InChI=1S/C5H9N3O3/c6-5-7-3(4(9)10)1-2-11-8-5/h3H,1-2H2,(H,9,10)(H3,6,7,8)/t3-/m0/s1

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InChIKey: UZFZWWMIJQSJMA-VKHMYHEASA-N

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Reference

NPASS: NPC273119

Properties Information

Molecule Weight: 159.145

TPSA: 94.44

MolLogP: -1.1111300000000002

Number of H-Donors: 4

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information