| SpectraBase Spectrum ID |
3BWfhhXzHoJ |
| Name |
Ethyl rel-(9aS,14aR,14bS)-9a-(2,3-Dihydro-1,3-dioxo-1H-inden-2-yl)-9a,14,14a,14b-tetrahydro-14-oxoindeno[2',1':3,4]pyrido[2,1-a]isoquinoline-9-carboxylate |
| Alternate Name(s) |
Ethyl (9aS,14aR,14bS)-9a-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)-14-oxo-9a,14,14a,14b-tetrahydroindeno[2',1':3,4]pyrido[2,1-a]isoquinoline-9-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H23NO5 |
| InChI |
InChI=1S/C32H23NO5/c1-2-38-31(37)24-17-33-16-15-18-9-3-4-10-19(18)27(33)25-30(36)22-13-7-8-14-23(22)32(24,25)26-28(34)20-11-5-6-12-21(20)29(26)35/h3-17,25-27H,2H2,1H3/t25-,27-,32+/m1/s1 |
| InChIKey |
IEQPJRGMPNYIEI-PEIKUDQGSA-N |
| Literature Reference DOI |
10.1002/hlca.201500194 |
| Molecular Weight |
501.538 g/mol |
| SMILES |
[C@@]12([C@]3([C@@](C(=CN2C=Cc2ccccc12)C(OCC)=O)(c1ccccc1C3=O)C1C(c2c(C1=O)cccc2)=O)[H])[H] |
| SPLASH |
splash10-056s-2936000000-a4de267fc6bcb0bf2425 |
| Source of Spectrum |
H-99-150-4b |
| Wiley ID |
1794938 |
![Ethyl rel-(9aS,14aR,14bS)-9a-(2,3-Dihydro-1,3-dioxo-1H-inden-2-yl)-9a,14,14a,14b-tetrahydro-14-oxoindeno[2',1':3,4]pyrido[2,1-a]isoquinoline-9-carboxylate](/api/spectrum/3BWfhhXzHoJ/structure.png?h=300&w=458 "Ethyl rel-(9aS,14aR,14bS)-9a-(2,3-Dihydro-1,3-dioxo-1H-inden-2-yl)-9a,14,14a,14b-tetrahydro-14-oxoindeno[2',1':3,4]pyrido[2,1-a]isoquinoline-9-carboxylate")
