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7-(Acetylamino)-10-(4-aminobutyl)-8,11-dioxo-19-oxa-9,12,17-triazatricyclo[14.2.1.0(5,18)]nonadeca-1(18),2,4,16-tetraene-13-carboxylic acid methyl ester
SpectraBase Compound ID F6iCc464WXy
InChI InChI=1S/C23H31N5O6/c1-13(29)25-17-12-14-6-5-8-18-20(14)28-19(34-18)10-9-16(23(32)33-2)27-21(30)15(26-22(17)31)7-3-4-11-24/h5-6,8,15-17H,3-4,7,9-12,24H2,1-2H3,(H,25,29)(H,26,31)(H,27,30)
InChIKey WUSVPMDTFFIYGV-UHFFFAOYSA-N
Mol Weight 473.53 g/mol
Molecular Formula C23H31N5O6
Exact Mass 473.227434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DAYnG8XbRE
Name 7-(Acetylamino)-10-(4-aminobutyl)-8,11-dioxo-19-oxa-9,12,17-triazatricyclo[14.2.1.0(5,18)]nonadeca-1(18),2,4,16-tetraene-13-carboxylic acid methyl ester
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Formula C23H31N5O6
InChI InChI=1S/C23H31N5O6/c1-13(29)25-17-12-14-6-5-8-18-20(14)28-19(34-18)10-9-16(23(32)33-2)27-21(30)15(26-22(17)31)7-3-4-11-24/h5-6,8,15-17H,3-4,7,9-12,24H2,1-2H3,(H,25,29)(H,26,31)(H,27,30)
InChIKey WUSVPMDTFFIYGV-UHFFFAOYSA-N
Molecular Weight 473.530 g/mol
SMILES N1C(CCCCN)C(NC(CCc2nc3c(cccc3CC(C1=O)NC(=O)C)o2)C(=O)OC)=O
SPLASH splash10-0v4i-4930400000-6b79e061625c19f87d9e
Source of Spectrum J-67-4892-32
Synonyms Methyl 7-(acetylamino)-10-(4-aminobutyl)-8,11-dioxo-19-oxa-9,12,17-triazatricyclo[14.2.1.0(5,18)]nonadeca-1(18),2,4,16-tetraene-13-carboxylate
Wiley ID 1570319