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7-(Acetylamino)-10-(carboxymethyl)-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 AOLBld0d4At
InChI InChI=1S/C21H24N4O8/c1-10(26)22-13-8-11-4-3-5-15-18(11)25-16(33-15)7-6-12(21(31)32-2)23-20(30)14(9-17(27)28)24-19(13)29/h3-5,12-14H,6-9H2,1-2H3,(H,22,26)(H,23,30)(H,24,29)(H,27,28)
InChIKey IQPJIZAUZRYFPD-UHFFFAOYSA-N
Mol Weight 460.44 g/mol
Molecular Formula C21H24N4O8
Exact Mass 460.159414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeV61AnLBAQ
Name 7-(Acetylamino)-10-(carboxymethyl)-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
Alternate Name(s) [7-(acetylamino)-13-(methoxycarbonyl)-8,11-dioxo-19-oxa-9,12,17-triazatricyclo[14.2.1.0(5,18)]nonadeca-1(18),2,4,16-tetraen-10-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N4O8
InChI InChI=1S/C21H24N4O8/c1-10(26)22-13-8-11-4-3-5-15-18(11)25-16(33-15)7-6-12(21(31)32-2)23-20(30)14(9-17(27)28)24-19(13)29/h3-5,12-14H,6-9H2,1-2H3,(H,22,26)(H,23,30)(H,24,29)(H,27,28)
InChIKey IQPJIZAUZRYFPD-UHFFFAOYSA-N
Molecular Weight 460.443 g/mol
SMILES N1C(CC(=O)O)C(NC(CCc2nc3c(cccc3CC(C1=O)NC(=O)C)o2)C(=O)OC)=O
SPLASH splash10-06tb-2950700000-bcdc6611e29f379b4110
Source of Spectrum J-67-4891-30
Wiley ID 1570320