| SpectraBase Spectrum ID |
KfhLkLzogfo |
| Name |
(Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-[(2-methylpropan-2-yl)oxy-oxomethoxy]-2-propenoic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H32N2O6 |
| InChI |
InChI=1S/C26H32N2O6/c1-6-16-14-28(31)12-11-18-17-9-7-8-10-21(17)27-23(18)22(28)13-19(16)20(24(29)32-5)15-33-25(30)34-26(2,3)4/h6-10,15,19,22,27H,11-14H2,1-5H3/b16-6+,20-15-/t19-,22-,28?/m0/s1 |
| InChIKey |
AOOBJDHQFKTYDY-KEZDUPHMSA-N |
| Molecular Weight |
468.550 g/mol |
| SMILES |
[nH]1c2ccccc2c2CC[N+]3([C@](c12)(C[C@@](\C(C3)=C/C)(\C(=C\OC(OC(C)(C)C)=O)C(=O)OC)[H])[H])[O-] |
| SPLASH |
splash10-014i-0900000000-b1502bdf82d03e7cd334 |
| Source of Spectrum |
F-52-6807-6 |
| Synonyms |
(Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-pyrido[2,1-a]$b-carbolin-5-ium-2-yl]-3-tert-butoxycarbonyloxy-acrylic acid methyl ester
methyl (Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxidanidyl-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-[(2-methylpropan-2-yl)oxycarbonyloxy]prop-2-enoate
methyl (Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-tert-butoxycarbonyloxy-prop-2-enoate
methyl (Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-[(2-methylpropan-2-yl)oxycarbonyloxy]prop-2-enoate |
| Wiley ID |
796519 |
![(Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-[(2-methylpropan-2-yl)oxy-oxomethoxy]-2-propenoic acid methyl ester](/api/spectrum/KfhLkLzogfo/structure.png?h=300&w=458 "(Z)-2-[(2S,3Z,12bS)-3-ethylidene-5-oxido-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl]-3-[(2-methylpropan-2-yl)oxy-oxomethoxy]-2-propenoic acid methyl ester")
