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1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

PropertiesImage
MNX_IDMNXM341259 Image of MNXM341259
referencechebi:96318
formulaC23H30N4O5
global charge0
mol weight442.516
InChIKeyDYLUPURRUAZIFP-YRNRMSPPSA-N
InChIInChI=1S/C23H30N4O5/c1-15-12-27(16(2)14-28)22(29)19-6-5-11-24-21(19)32-20(15)13-26(3)23(30)25-17-7-9-18(31-4)10-8-17/h5-11,15-16,20,28H,12-14H2,1-4H3,(H,25,30)/t15-,16+,20-/m0/s1
SMILESCOC1=CC=C(NC(=O)N(C)C[C@@H]2OC3=C(C=CC=N3)C(=O)N([C@H](C)CO)C[C@@H]2C)C=C1
MNX internals
InChI (mnx)InChI=1/C23H30N4O5/c1-15-12-27(16(2)14-28)22(29)19-6-5-11-24-21(19)32-20(15)13-26(3)23(30)25-17-7-9-18(31-4)10-8-17/h5-11,15-16,20,28H,12-14H2,1-4H3,(H,25,30)/t15-,16+,20-/m0/s1 Image of MNXM341259
SMILES (mnx)[CH3:1][C@H:15]1[CH2:12][N:27]([C@H:16]([CH3:2])[CH2:14][OH:28])[C:22](=[O:29])[C:19]2=[C:21]([N:24]=[CH:11][CH:5]=[CH:6]2)[O:32][C@H:20]1[CH2:13][N:26]([CH3:3])[C:23]([NH:25][C:17]1=[CH:8][CH:10]=[C:18]([O:31][CH3:4])[CH:9]=[CH:7]1)=[O:30]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:96318
chebi:96318
DYLUPURRUAZIFP-YRNRMSPPSA-N
1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea