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CHEBI:129976 - N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(phenylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1,3-benzothiazole-2-carboxamide

Default Structure
ChEBI IDCHEBI:129976
ChEBI NameN-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(phenylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1,3-benzothiazole-2-carboxamide
Stars
DownloadsMolfile
FormulaC31H34N4O4S
Net Charge0
Average Mass558.704
Monoisotopic Mass558.23008
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C1=O
InChIInChI=1S/C31H34N4O4S/c1-20-16-35(21(2)19-36)31(38)23-12-9-14-25(32-29(37)30-33-24-13-7-8-15-27(24)40-30)28(23)39-26(20)18-34(3)17-22-10-5-4-6-11-22/h4-15,20-21,26,36H,16-19H2,1-3H3,(H,32,37)/t20-,21+,26-/m0/s1
InChIKeyHGFXOAFBCBBPMM-UZINWLIJSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(phenylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1,3-benzothiazole-2-carboxamide (CHEBI:129976) is a benzothiazoles (CHEBI:37947)
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