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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > histidine derivative > azetirelin

Preferred term

azetirelin  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C15H20N6O4

inchi

  • InChI=1S/C15H20N6O4/c16-13(23)11-2-1-3-21(11)15(25)10(4-8-6-17-7-18-8)20-14(24)9-5-12(22)19-9/h6-7,9-11H,1-5H2,(H2,16,23)(H,17,18)(H,19,22)(H,20,24)/t9-,10-,11-/m0/s1

inchikey

  • WBGUMUGCONUXFK-DCAQKATOSA-N

mass

  • 348.363

monoisotopicmass

  • 348.15460

smiles

  • O=C(N1[C@@H](CCC1)C(=O)N)[C@@H](NC(=O)[C@H]2NC(=O)C2)CC=3NC=NC3

subset

  • 2_STAR

synonym EXACT

  • (2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-oxoazetidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230038

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