| SpectraBase Spectrum ID |
9Tl4O2COAzn |
| Name |
1H-Pyrrole-3-propanoic acid, 2-[[4-(2-carboxyethyl)-5-[(1,1-dimethylethoxy)carbonyl]-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-5-[(phenylmethoxy)carbonyl]-, .alpha.-methyl ester |
| CAS Registry Number |
99602-78-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H38N2O8 |
| InChI |
InChI=1S/C31H38N2O8/c1-18-22(12-14-25(34)35)28(30(38)41-31(3,4)5)32-23(18)16-24-21(13-15-26(36)39-6)19(2)27(33-24)29(37)40-17-20-10-8-7-9-11-20/h7-11,32-33H,12-17H2,1-6H3,(H,34,35) |
| InChIKey |
MWZVNGQCROVFGX-UHFFFAOYSA-N |
| Molecular Weight |
566.651 g/mol |
| SMILES |
[nH]1c(c(CCC(=O)O)c(C)c1Cc1[nH]c(c(c1CCC(=O)OC)C)C(OCc1ccccc1)=O)C(OC(C)(C)C)=O |
| SPLASH |
splash10-014i-0000920000-623db9072ac7ea895acf |
| Source of Spectrum |
KC-1985-1706-30 |
| Synonyms |
3-[5-{[5-[(benzyloxy)carbonyl]-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrol-2-yl]methyl}-2-(tert-butoxycarbonyl)-4-methyl-1H-pyrrol-3-yl]propanoic acid
t-Butyl 5-carboxy-3-(2-methoxycarbonylethyl)-4'-(2-carboxyethyl)-3',4-dimethyl-2,2'-methylenedipyrrole-5'-carboxylate |
| Wiley ID |
1407322 |
![1H-Pyrrole-3-propanoic acid, 2-[[4-(2-carboxyethyl)-5-[(1,1-dimethylethoxy)carbonyl]-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-5-[(phenylmethoxy)carbonyl]-, .alpha.-methyl ester](/api/spectrum/9Tl4O2COAzn/structure.png?h=300&w=458 "1H-Pyrrole-3-propanoic acid, 2-[[4-(2-carboxyethyl)-5-[(1,1-dimethylethoxy)carbonyl]-3-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-5-[(phenylmethoxy)carbonyl]-, .alpha.-methyl ester")
