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CHEBI:96276 - 3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea

ChEBI IDCHEBI:96276
ChEBI Name3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea
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DownloadsMolfile
FormulaC22H38N6O4
Net Charge0
Average Mass450.584
Monoisotopic Mass450.29545
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)CCCn2nncc2CO[C@@H]1CN(C)C(=O)NC1CCCC1
InChIInChI=1S/C22H38N6O4/c1-16-12-27(17(2)14-29)21(30)9-6-10-28-19(11-23-25-28)15-32-20(16)13-26(3)22(31)24-18-7-4-5-8-18/h11,16-18,20,29H,4-10,12-15H2,1-3H3,(H,24,31)/t16-,17+,20-/m1/s1
InChIKeyJDDXXTSIDDFAIE-FUHIMQAGSA-N
ChEBI Ontology
Outgoing Relation(s)
3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea (CHEBI:96276) is a azamacrocycle (CHEBI:52898)
3-cyclopentyl-1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methylurea (CHEBI:96276) is a lactam (CHEBI:24995)
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