| SpectraBase Spectrum ID |
AAepqOwtoPV |
| Name |
Isoxazolo[5,4-e]indolizine-6,8-dicarboxylic acid, 3a,5a,6,7,8,9a-hexahydro-3-phenyl-, dimethyl ester, (3a.alpha.,5a.alpha.,6.beta.,8.alpha.,9a.alpha.)- |
| CAS Registry Number |
110311-92-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H20N2O5 |
| InChI |
InChI=1S/C19H20N2O5/c1-24-18(22)13-10-15(19(23)25-2)21-14(13)9-8-12-16(20-26-17(12)21)11-6-4-3-5-7-11/h3-9,12-15,17H,10H2,1-2H3/t12-,13+,14+,15-,17+/m0/s1 |
| InChIKey |
HRZXYWUVDYHPPA-SOXILONMSA-N |
| Molecular Weight |
356.378 g/mol |
| SMILES |
[C@]12(N3[C@](C=C[C@]2(C(c2ccccc2)=NO1)[H])([C@](C(=O)OC)(C[C@]3(C(=O)OC)[H])[H])[H])[H] |
| SPLASH |
splash10-0udi-0900000000-3cdd13c4aeff64e803cd |
| Source of Spectrum |
AJ-59-3634-15 |
| Synonyms |
1,3-di(methoxycarbonyl)-6-(p-methoxyphenyl)-1,2,3,3b,6b,8a-hexahydroindolizino[5,6-d]isoxazole
dimethyl (3aS,5aR,6R,8S,9aR)-3-phenyl-3a,5a,6,7,8,9a-hexahydroisoxazolo[5,4-e]indolizine-6,8-dicarboxylate
Steroisomer 1,3-di(methoxycarbonyl)-6-(p-methoxyphenyl)-1,2,3,3b,6b,8a-hexahydroindolizino[5,6-d]isoxazole |
| Wiley ID |
1345738 |
![Isoxazolo[5,4-e]indolizine-6,8-dicarboxylic acid, 3a,5a,6,7,8,9a-hexahydro-3-phenyl-, dimethyl ester, (3a.alpha.,5a.alpha.,6.beta.,8.alpha.,9a.alpha.)-](/api/spectrum/AAepqOwtoPV/structure.png?h=300&w=458 "Isoxazolo[5,4-e]indolizine-6,8-dicarboxylic acid, 3a,5a,6,7,8,9a-hexahydro-3-phenyl-, dimethyl ester, (3a.alpha.,5a.alpha.,6.beta.,8.alpha.,9a.alpha.)-")
