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(phenylmethyl) 4-ethanoyl-5-[[2-[(3-ethanoyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate

View entire compound with spectra: 1 MS (GC)

(phenylmethyl) 4-ethanoyl-5-[[2-[(3-ethanoyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID I6vL1vcHbOM
InChI InChI=1S/C44H41N3O8/c1-26-38(28(3)48)35(46-40(26)43(51)54-24-31-16-10-6-11-17-31)20-33-21-37(42(50)53-23-30-14-8-5-9-15-30)45-34(33)22-36-39(29(4)49)27(2)41(47-36)44(52)55-25-32-18-12-7-13-19-32/h5-19,21,45-47H,20,22-25H2,1-4H3
InChIKey ZVOOUOKTIUBSJF-UHFFFAOYSA-N
Mol Weight 739.8 g/mol
Molecular Formula C44H41N3O8
Exact Mass 739.289365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sP4U84NMpx
Name (phenylmethyl) 4-ethanoyl-5-[[2-[(3-ethanoyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H41N3O8
InChI InChI=1S/C44H41N3O8/c1-26-38(28(3)48)35(46-40(26)43(51)54-24-31-16-10-6-11-17-31)20-33-21-37(42(50)53-23-30-14-8-5-9-15-30)45-34(33)22-36-39(29(4)49)27(2)41(47-36)44(52)55-25-32-18-12-7-13-19-32/h5-19,21,45-47H,20,22-25H2,1-4H3
InChIKey ZVOOUOKTIUBSJF-UHFFFAOYSA-N
Molecular Weight 739.825 g/mol
SMILES [nH]1c(c(c(c1Cc1c(Cc2c(c(c([nH]2)C(OCc2ccccc2)=O)C)C(=O)C)cc([nH]1)C(OCc1ccccc1)=O)C(=O)C)C)C(OCc1ccccc1)=O
SPLASH splash10-056u-9400000000-ee57b8e4639e5d0957d2
Source of Spectrum KC-0-1792-18
Synonyms 4-Acetyl-5-[[2-[(3-acetyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester 4-Acetyl-5-[[2-[(3-acetyl-5-carbobenzoxy-4-methyl-1H-pyrrol-2-yl)methyl]-5-carbobenzoxy-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester benzyl 4-acetyl-5-[[2-[(3-acetyl-4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate benzyl 4-acetyl-5-[[2-[(3-acetyl-5-benzyloxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-5-benzyloxycarbonyl-1H-pyrrol-3-yl]methyl]-3-methyl-1H-pyrrole-2-carboxylate
Wiley ID 786139