| SpectraBase Spectrum ID |
4vTACec9lV7 |
| Name |
2-[(2S,3S,12bS)-3-(3-keto-3-methoxy-propyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyano-acetic acid methyl ester |
| Alternate Name(s) |
2-[(2S,3S,12bS)-3-(3-methoxy-3-oxopropyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyanoacetic acid methyl ester
Methyl 2-[(2S,3S,12bS)-3-(3-methoxy-3-oxidanylidene-propyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyano-ethanoate
Methyl 2-[(2S,3S,12bS)-3-(3-methoxy-3-oxo-propyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyano-acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26N2O6 |
| InChI |
InChI=1S/C22H26N2O6/c1-27-21(25)4-3-14-11-24-6-5-13-7-19-20(30-12-29-19)9-16(13)18(24)8-15(14)17(10-23)22(26)28-2/h7,9,14-15,17-18H,3-6,8,11-12H2,1-2H3/t14-,15+,17?,18+/m1/s1 |
| InChIKey |
SDRSYKAIEUPFNP-COJCKYOVSA-N |
| Molecular Weight |
414.458 g/mol |
| SMILES |
[C@@]12(N(CCc3cc4OCOc4cc23)C[C@]([C@](C1)(C(C(=O)OC)C#N)[H])(CCC(=O)OC)[H])[H] |
| SPLASH |
splash10-014i-0129400000-3f559b4d3bd57b5a8743 |
| Source of Spectrum |
H1-39-454-5 |
| Wiley ID |
756778 |
![2-[(2S,3S,12bS)-3-(3-keto-3-methoxy-propyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyano-acetic acid methyl ester](/api/spectrum/4vTACec9lV7/structure.png?h=300&w=458 "2-[(2S,3S,12bS)-3-(3-keto-3-methoxy-propyl)-2,3,4,6,7,12b-hexahydro-1H-[1,3]benzodioxolo[6,5-a]quinolizin-2-yl]-2-cyano-acetic acid methyl ester")
