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CHEBI:96298 - 1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea

ChEBI IDCHEBI:96298
ChEBI Name1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea
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FormulaC27H31N5O4
Net Charge0
Average Mass489.576
Monoisotopic Mass489.23760
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cc(-c3cccnc3)cnc2O[C@H]1CN(C)C(=O)Nc1ccccc1
InChIInChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24+/m1/s1
InChIKeyBUQVOPHSTBMFAQ-IECBHUPTSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-(3-pyridinyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-phenylurea (CHEBI:96298) is a bipyridines (CHEBI:50511)
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