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1H-Pyrrole-3-propanoic acid, 2-[[5-(dimethoxymethyl)-3-(3-methoxy-3-oxopropyl)-4-methyl-2H-pyrrol-2-ylidene]methyl]-5-[(3-ethenyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-4-methyl-, methyl ester, (Z,Z)-
SpectraBase Compound ID DLUPVhntHgt
InChI InChI=1S/C30H37N3O7/c1-9-19-18(4)29(36)33-23(19)14-22-16(2)20(10-12-26(34)37-5)24(31-22)15-25-21(11-13-27(35)38-6)17(3)28(32-25)30(39-7)40-8/h9,14-15,30-31H,1,10-13H2,2-8H3,(H,33,36)/b23-14-,25-15-
InChIKey WTQHNEFYLHKPCF-REWGPEIWSA-N
Mol Weight 551.6 g/mol
Molecular Formula C30H37N3O7
Exact Mass 551.263151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7i41fH9PoH
Name 1H-Pyrrole-3-propanoic acid, 2-[[5-(dimethoxymethyl)-3-(3-methoxy-3-oxopropyl)-4-methyl-2H-pyrrol-2-ylidene]methyl]-5-[(3-ethenyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-4-methyl-, methyl ester, (Z,Z)-
CAS Registry Number 113396-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H37N3O7
InChI InChI=1S/C30H37N3O7/c1-9-19-18(4)29(36)33-23(19)14-22-16(2)20(10-12-26(34)37-5)24(31-22)15-25-21(11-13-27(35)38-6)17(3)28(32-25)30(39-7)40-8/h9,14-15,30-31H,1,10-13H2,2-8H3,(H,33,36)/b23-14-,25-15-
InChIKey WTQHNEFYLHKPCF-REWGPEIWSA-N
Molecular Weight 551.640 g/mol
SMILES [nH]1c(c(c(c1\C=C/1NC(C(=C1C=C)C)=O)C)CCC(=O)OC)\C=C\1N=C(C(C)=C1CCC(=O)OC)C(OC)OC
SPLASH splash10-006x-9200000000-ba47133584ca24d6d5f3
Source of Spectrum AJ-60-4048-0
Synonyms 8,12-bis[2-(methoxycarbonyl)ethyl]-2,7,13-trimethyl-1-oxo-3-vinyltripyrrin-14-carbaldehyde dimethyl acetal Methyl 3-[(2Z)-5-(dimethoxymethyl)-2-({3-(3-methoxy-3-oxopropyl)-4-methyl-5-[(Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-1H-pyrrol-2-yl}methylene)-4-methyl-2H-pyrrol-3-yl]propanoate
Wiley ID 1405852