| SpectraBase Spectrum ID |
jDotJK32Pv |
| Name |
2,3-Dihydrodeacetyltatsiensine |
| Alternate Name(s) |
20-Ethyl-1,14,16-trimethoxy-4-methyl-7,8-(methylenebis(oxy))aconitan-6-ol (1alpha,6beta,14alpha,16beta)-
Aconitan-6-ol, 20-ethyl-1,14,16-trimethoxy-4-methyl-7,8-(methylenebis(oxy))-, (1alpha,6beta,14alpha,16beta)- |
| CAS Registry Number |
509-28-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H39NO6 |
| InChI |
InChI=1S/C25H39NO6/c1-6-26-11-22(2)8-7-16(29-4)24-14-9-13-15(28-3)10-23(17(14)18(13)30-5)25(21(24)26,32-12-31-23)20(27)19(22)24/h13-21,27H,6-12H2,1-5H3/t13-,14+,15?,16?,17+,18?,19-,20?,21-,22-,23+,24-,25+/m0/s1 |
| InChIKey |
QZRLLIOCIZLBGL-ODRXEQBGSA-N |
| Molecular Weight |
449.588 g/mol |
| SMILES |
OC1[C@]2([C@]3(CCC([C@]22[C@@]([C@@]11[C@@]4([C@]5(C(OC)[C@](C(C4)OC)(C[C@@]25[H])[H])[H])OCO1)(N(C3)CC)[H])OC)C)[H] |
| SPLASH |
splash10-014i-0000900000-ff0dbae1684bd314aa55 |
| Source of Spectrum |
F-45-1891-7 |
| Wiley ID |
1387454 |
