| SpectraBase Spectrum ID |
JwuPNt0zz2d |
| Name |
(2S,12bS)-2-[(1R,2R)-1-carbomethoxy-2-hydroxy-propyl]-1,2,6,7,12,12b-hexahydropyrido[2,1-a]$b-carboline-3-carboxylic acid tert-butyl ester |
| Alternate Name(s) |
(2S,12bS)-2-[(2R,3R)-3-hydroxy-1-methoxy-1-oxobutan-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylic acid tert-butyl ester
tert-butyl (2S,12bS)-2-[(2R,3R)-1-methoxy-3-oxidanyl-1-oxidanylidene-butan-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate
tert-butyl (2S,12bS)-2-[(2R,3R)-3-hydroxy-1-methoxy-1-oxobutan-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H32N2O5 |
| InChI |
InChI=1S/C25H32N2O5/c1-14(28)21(24(30)31-5)17-12-20-22-16(15-8-6-7-9-19(15)26-22)10-11-27(20)13-18(17)23(29)32-25(2,3)4/h6-9,13-14,17,20-21,26,28H,10-12H2,1-5H3/t14-,17-,20+,21+/m1/s1 |
| InChIKey |
IQAKZXMIOOTXES-LPNJYYIDSA-N |
| Molecular Weight |
440.540 g/mol |
| SMILES |
O[C@@]([C@@]([C@]1(C(=CN2[C@](c3c(CC2)c2ccccc2[nH]3)(C1)[H])C(OC(C)(C)C)=O)[H])(C(=O)OC)[H])(C)[H] |
| SPLASH |
splash10-014i-0090300000-0f79851c08c9d925f620 |
| Source of Spectrum |
U-1996-353-10 |
| Wiley ID |
768161 |
![(2S,12bS)-2-[(1R,2R)-1-carbomethoxy-2-hydroxy-propyl]-1,2,6,7,12,12b-hexahydropyrido[2,1-a]$b-carboline-3-carboxylic acid tert-butyl ester](/api/spectrum/JwuPNt0zz2d/structure.png?h=300&w=458 "(2S,12bS)-2-[(1R,2R)-1-carbomethoxy-2-hydroxy-propyl]-1,2,6,7,12,12b-hexahydropyrido[2,1-a]$b-carboline-3-carboxylic acid tert-butyl ester")
