| SpectraBase Compound ID | 7C68pL9CR5n |
|---|---|
| InChI | InChI=1S/C24H30N2O5/c1-13(27)31-21-7-4-14-12-26-9-8-17-16-6-5-15(29-2)10-19(16)25-23(17)20(26)11-18(14)22(21)24(28)30-3/h5-6,10,14,18,20-22,25H,4,7-9,11-12H2,1-3H3/t14-,18-,20-,21-,22+/m0/s1 |
| InChIKey | UEFILKPKYUBUOT-DUFDLUDNSA-N |
| Mol Weight | 426.51 g/mol |
| Molecular Formula | C24H30N2O5 |
| Exact Mass | 426.215472 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JvhEhAF78ZE |
|---|---|
| Name | 11.alpha.-methoxy-17-acetyl-yohimbine |
| Alternate Name(s) | (16alpha,17alpha)-11-methoxy-16-(methoxycarbonyl)yohimban-17-yl acetate (1R,2S,4aR,13bS,14aS)-2-acetoxy-11-methoxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroisoquinolino[3,2-a]$b-carboline-1-carboxylic acid methyl ester (1S,15R,18S,19R,20S)-18-acetyloxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid methyl ester Methyl (1S,15R,18S,19R,20S)-18-acetoxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate Methyl (1S,15R,18S,19R,20S)-18-acetyloxy-6-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H30N2O5 |
| InChI | InChI=1S/C24H30N2O5/c1-13(27)31-21-7-4-14-12-26-9-8-17-16-6-5-15(29-2)10-19(16)25-23(17)20(26)11-18(14)22(21)24(28)30-3/h5-6,10,14,18,20-22,25H,4,7-9,11-12H2,1-3H3/t14-,18-,20-,21-,22+/m0/s1 |
| InChIKey | UEFILKPKYUBUOT-DUFDLUDNSA-N |
| Molecular Weight | 426.513 g/mol |
| SMILES | [nH]1c2cc(ccc2c2c1[C@]1(N(CC2)C[C@@]2(CC[C@@]([C@@]([C@]2(C1)[H])(C(=O)OC)[H])(OC(=O)C)[H])[H])[H])OC |
| SPLASH | splash10-005i-0931400000-d6751c8c6416f8051e90 |
| Source of Spectrum | X2-45-743-12 |
| Wiley ID | 1601033 |