| SpectraBase Spectrum ID |
D7g6EHb1HE8 |
| Name |
21H-Biline-8,12-dipropanoic acid, 3,18-diethyl-1,2,3,4,5,19,22,24-octahydro-2,7,13,17-tetramethyl-1,19-dioxo-, (2R,3R,4R)- |
| CAS Registry Number |
77611-12-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H46N4O6 |
| InChI |
InChI=1S/C35H46N4O6/c1-7-22-21(6)34(44)39-29(22)16-27-20(5)25(12-10-14-33(42)43)31(37-27)17-30-24(11-9-13-32(40)41)19(4)26(36-30)15-28-18(3)23(8-2)35(45)38-28/h15,17,21-22,29,37H,7-14,16H2,1-6H3,(H,38,45)(H,39,44)(H,40,41)(H,42,43)/b28-15-,30-17-/t21-,22-,29-/m1/s1 |
| InChIKey |
YYXIFYQVTPHJNK-RNRZSMPASA-N |
| Molecular Weight |
618.775 g/mol |
| SMILES |
N1C(C(=C(\C1=C/C1=N\C(=C/c2c(CCCC(=O)O)c(C)c([nH]2)C[C@]2(NC([C@@]([C@]2(CC)[H])(C)[H])=O)[H])C(=C1C)CCCC(=O)O)C)CC)=O |
| SPLASH |
splash10-00kf-0379802000-865cbfc667bc8d067912 |
| Source of Spectrum |
W5-1989-1691-1 |
| Synonyms |
4-(2-((Z)-{3-(3-carboxypropyl)-5-[(Z)-(4-ethyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl)-5-{[(2R,3R,4R)-3-ethyl-4-methyl-5-oxopyrrolidinyl]methyl}-4-methyl-1H-pyrrol-3-yl)butanoic acid |
| Wiley ID |
1411420 |
