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(phenylmethyl) 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate

View entire compound with spectra: 1 MS (GC)

(phenylmethyl) 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate
SpectraBase Compound ID IuRB9WLtBJP
InChI InChI=1S/C36H44N2O12/c1-36(2,3)50-35(44)32-23(14-16-29(40)46-5)24(17-30(41)47-6)27(38-32)19-26-22(13-15-28(39)45-4)25(18-31(42)48-7)33(37-26)34(43)49-20-21-11-9-8-10-12-21/h8-12,37-38H,13-20H2,1-7H3
InChIKey JMYQVCYXXIKGNA-UHFFFAOYSA-N
Mol Weight 696.8 g/mol
Molecular Formula C36H44N2O12
Exact Mass 696.289425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uB8NA0qYx6
Name (phenylmethyl) 3-(2-methoxy-2-oxidanylidene-ethyl)-5-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate
CAS Registry Number 61637-68-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H44N2O12
InChI InChI=1S/C36H44N2O12/c1-36(2,3)50-35(44)32-23(14-16-29(40)46-5)24(17-30(41)47-6)27(38-32)19-26-22(13-15-28(39)45-4)25(18-31(42)48-7)33(37-26)34(43)49-20-21-11-9-8-10-12-21/h8-12,37-38H,13-20H2,1-7H3
InChIKey JMYQVCYXXIKGNA-UHFFFAOYSA-N
Molecular Weight 696.750 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c([nH]1)C(OCc1ccccc1)=O)CC(=O)OC)CCC(=O)OC)CC(=O)OC)CCC(=O)OC)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-0000491000-b08424f57b4b66f7e043
Source of Spectrum KC-1988-1564-24
Synonyms 3-(2-Methoxy-2-oxoethyl)-5-[[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-[(2-methylpropan-2-yl)oxy-oxomethyl]-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester 5-[[5-tert-butoxycarbonyl-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrol-2-yl]methyl]-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid benzyl ester benzyl 3-(2-methoxy-2-oxoethyl)-5-[[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate benzyl 5-[[5-tert-butoxycarbonyl-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrol-2-yl]methyl]-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylate
Wiley ID 1414930