| SpectraBase Spectrum ID |
XBORlx7WPC |
| Name |
Methyl 3-benzyl-8-(1'-trityl-1H-imidazol-4'-yl)-7-nitro-6-oxo-3,4,6,7,8,9-hexahydroimidazo[4,5-f]indolizine-8a-carcoxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H34N6O5 |
| InChI |
InChI=1S/C40H34N6O5/c1-51-38(48)39-22-32-34(43(26-41-32)23-28-14-6-2-7-15-28)25-45(39)37(47)36(46(49)50)35(39)33-24-44(27-42-33)40(29-16-8-3-9-17-29,30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-21,24,26-27,35-36H,22-23,25H2,1H3/t35-,36-,39+/m0/s1 |
| InChIKey |
KLQINIQQEHVXHI-VHYZKNOSSA-N |
| Molecular Weight |
678.749 g/mol |
| SMILES |
[C@]12(N(C(=O)[C@]([C@@]2(c2nc[n](c2)C(c2ccccc2)(c2ccccc2)c2ccccc2)[H])(N(=O)=O)[H])Cc2c(C1)nc[n]2Cc1ccccc1)C(=O)OC |
| SPLASH |
splash10-00kf-3690000000-a5c302750a63ee0a585c |
| Source of Spectrum |
Y4-40-922-9 |
| Synonyms |
(7S,8R,8aR)-7-nitro-6-oxo-3-(phenylmethyl)-8-[1-(triphenylmethyl)-4-imidazolyl]-4,7,8,9-tetrahydroimidazo[4,5-f]indolizine-8a-carboxylic acid methyl ester
Methyl (7S,8R,8aR)-3-benzyl-7-nitro-6-oxo-8-(1-tritylimidazol-4-yl)-4,7,8,9-tetrahydroimidazo[4,5-f]indolizine-8a-carboxylate
Methyl (7S,8R,8aR)-7-nitro-6-oxidanylidene-3-(phenylmethyl)-8-[1-(triphenylmethyl)imidazol-4-yl]-4,7,8,9-tetrahydroimidazo[4,5-f]indolizine-8a-carboxylate |
| Wiley ID |
1567200 |
![METHYL-(7S*,8R*,8AR*)-3-BENZYL-8-(1'-TRITYL-1'H-IMIDAZOL-4'-YL)-7-NITRO-6-OXO-3,4,6,7,8-HEXAHYDROIMIDAZO-[4,5-F]-INDOLIZIN-8A-CARBOXYLATE](/api/spectrum/XBORlx7WPC/structure.png?h=300&w=458 "METHYL-(7S*,8R*,8AR*)-3-BENZYL-8-(1'-TRITYL-1'H-IMIDAZOL-4'-YL)-7-NITRO-6-OXO-3,4,6,7,8-HEXAHYDROIMIDAZO-[4,5-F]-INDOLIZIN-8A-CARBOXYLATE")
