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CHEBI:96846 - (8R,9S)-9-[[(3-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

ChEBI IDCHEBI:96846
ChEBI Name(8R,9S)-9-[[(3-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
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DownloadsMolfile
FormulaC23H35N5O4
Net Charge0
Average Mass445.564
Monoisotopic Mass445.26890
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)CCCn2nncc2CO[C@@H]1CN(C)Cc1cccc(O)c1
InChIInChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m1/s1
InChIKeyGQDZDOSXBZGUQJ-KGVIQGDOSA-N
ChEBI Ontology
Outgoing Relation(s)
(8R,9S)-9-[[(3-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:96846) is a azamacrocycle (CHEBI:52898)
(8R,9S)-9-[[(3-hydroxyphenyl)methyl-methylamino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:96846) is a lactam (CHEBI:24995)
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