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21H-Biline-8,12-dipropanoic acid, 18-ethyl-1,2,3,19,23,24-hexahydro-3-(1-methoxyethyl)-2,7,13,17-tetram ethyl-1,19-dioxo-, dimethyl ester, [2R*,3R*(R*)]-(.+-.)-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

21H-Biline-8,12-dipropanoic acid, 18-ethyl-1,2,3,19,23,24-hexahydro-3-(1-methoxyethyl)-2,7,13,17-tetram ethyl-1,19-dioxo-, dimethyl ester, [2R*,3R*(R*)]-(.+-.)-
SpectraBase Compound ID 4ccpXDFue2Z
InChI InChI=1S/C36H46N4O7/c1-10-23-18(2)28(39-36(23)44)15-26-19(3)24(11-13-32(41)46-8)29(37-26)17-30-25(12-14-33(42)47-9)20(4)27(38-30)16-31-34(22(6)45-7)21(5)35(43)40-31/h15-17,21-22,34,37-38H,10-14H2,1-9H3,(H,39,44)/b27-16-,28-15-,30-17-
InChIKey LVKGNXGWKOWYMB-ZHXZQDCLSA-N
Mol Weight 646.8 g/mol
Molecular Formula C36H46N4O7
Exact Mass 646.33665 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jk8eEaxn71F
Name 21H-Biline-8,12-dipropanoic acid, 18-ethyl-1,2,3,19,23,24-hexahydro-3-(1-methoxyethyl)-2,7,13,17-tetram ethyl-1,19-dioxo-, dimethyl ester, [2R*,3R*(R*)]-(.+-.)-
CAS Registry Number 77286-48-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H46N4O7
InChI InChI=1S/C36H46N4O7/c1-10-23-18(2)28(39-36(23)44)15-26-19(3)24(11-13-32(41)46-8)29(37-26)17-30-25(12-14-33(42)47-9)20(4)27(38-30)16-31-34(22(6)45-7)21(5)35(43)40-31/h15-17,21-22,34,37-38H,10-14H2,1-9H3,(H,39,44)/b27-16-,28-15-,30-17-
InChIKey LVKGNXGWKOWYMB-ZHXZQDCLSA-N
Molecular Weight 646.785 g/mol
SMILES [nH]1c(\C=C/2C(=C(\C(N2)=C/C2=NC(=O)C(C2C(OC)C)C)C)CCC(=O)OC)c(c(C)c1\C=C/1NC(C(=C1C)CC)=O)CCC(=O)OC
SPLASH splash10-0gvk-1104049000-b2c2c491d7c2bc581611
Source of Spectrum K-114-142-0
Synonyms 21H-Biline-8,12-dipropanoic acid, 18-ethyl-1,2,3,19,23,24-hexahydro-3-(1-methoxyethyl)-2,7,13,17-tetram ethyl-1,19-dioxo-, dimethyl ester, [2R*,3R*(S*)]-(.+-.)- Methyl 3-(5-[(Z)-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-{(Z)-[(5Z)-5-{[4-(1-methoxyethyl)-3-methyl-2-oxo-3,4-dihydro-2H-pyrrol-5-yl]methylene}-3-(3-methoxy-3-oxopropyl)-4-methyl-1,5-dihydro-2H-pyrrol-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoate Methyl ester of (2RS,3RS,3'RS)-18-ethyl-3-(1-methoxyethyl)-1,2,3,19,22,24-hexahydro-2,7,13,17-tetramethyl-1,19-dioxo-21H-bilin-8,12-dipropionic acid Methyl ester of (2RS,3RS,3'SR)-18-ethyl-3-(1-methoxyethyl)-1,2,3,19,22,24-hexahydro-2,7,13,17-tetramethyl-1,19-dioxo-21H-bilin-8,12-dipropionic acid
Wiley ID 1412919