CHEBI:113526 - (8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
ChEBI ID CHEBI:113526
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H37N5O3
Net Charge 0
Average Mass 443.583
Monoisotopic Mass 443.28964
InChI InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23-/m1/s1
InChIKey UFUZIZHGCRPPRZ-TXTKFYIRSA-N
SMILES C[C@@H]1CN(C(=O)CCCN2C(=CN=N2)CO[C@@H]1CN(C)CC3=CC=CC=C3C)[C@H](C)CO
ChEBI Ontology
Outgoing (8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:113526) is a azamacrocycle (CHEBI:52898)
(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-9-[[methyl-[(2-methylphenyl)methyl]amino]methyl]-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:113526) is a lactam (CHEBI:24995)
Manual Xref Database
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