| SpectraBase Spectrum ID |
4aNzhWRHRqX |
| Name |
1H-Pyrrole-3-propanoic acid, 3-[[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methylene]-2,5-dihydro-4-(2-methoxy-2-oxoethyl)-1-methyl-5-oxo-, methyl ester, (Z)- |
| Alternate Name(s) |
1,10-Dihydro-3,8-bis(2-methoxycarbonylethyl)-2,7-bis(methoxy-carbonylmethyl)-10-methyl-1-oxodipyrrin-9-carbaldehyde
methyl (4E)-4-[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-2H-pyrrol-2-ylidene]-4-[4-(2-methoxy-2-oxoethyl)-1-methyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yl]butanoate |
| CAS Registry Number |
118826-27-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H30N2O10 |
| InChI |
InChI=1S/C25H30N2O10/c1-27-12-18(17(25(27)33)11-23(32)37-5)15(7-9-21(30)35-3)24-16(10-22(31)36-4)14(19(13-28)26-24)6-8-20(29)34-2/h13H,6-12H2,1-5H3/b24-15+ |
| InChIKey |
BRYVHGVMCJPPSF-BUVRLJJBSA-N |
| Molecular Weight |
518.519 g/mol |
| SMILES |
C=1(\C(N=C(C1CCC(=O)OC)C=O)=C/(C1=C(C(=O)N(C1)C)CC(=O)OC)CCC(=O)OC)CC(=O)OC |
| SPLASH |
splash10-014i-0000390000-5336a6a82527066da7f9 |
| Source of Spectrum |
KC-1988-1565-27 |
| Wiley ID |
1401646 |
![1H-Pyrrole-3-propanoic acid, 3-[[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methylene]-2,5-dihydro-4-(2-methoxy-2-oxoethyl)-1-methyl-5-oxo-, methyl ester, (Z)-](/api/spectrum/4aNzhWRHRqX/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 3-[[5-formyl-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-2-yl]methylene]-2,5-dihydro-4-(2-methoxy-2-oxoethyl)-1-methyl-5-oxo-, methyl ester, (Z)-")
