CHEBI:106198 - N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzamide

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ChEBI Name N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzamide
ChEBI ID CHEBI:106198
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H33N3O4
Net Charge 0
Average Mass 463.570
Monoisotopic Mass 463.24711
InChI InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24-/m0/s1
InChIKey NKXMQWDASBSVNS-ROKPMTFOSA-N
SMILES CCCC#CC1=CC2=C(N=C1)O[C@H]([C@H](CN(C2=O)[C@H](C)CO)C)CN(C)C(=O)C3=CC=CC=C3
ChEBI Ontology
Outgoing N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzamide (CHEBI:106198) is a benzamides (CHEBI:22702)
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