| SpectraBase Compound ID | FxBjesM0gOf |
|---|---|
| InChI | InChI=1S/C28H32N2O4/c1-3-27(14-9-17-34-24(31)19-10-5-4-6-11-19)18-20(25(32)33-2)23-28(15-16-29-26(27)28)21-12-7-8-13-22(21)30-23/h4-8,10-13,26,29-30H,3,9,14-18H2,1-2H3/t26-,27+,28-/m0/s1 |
| InChIKey | ZKQKZYVZGMHZJA-IARZGTGTSA-N |
| Mol Weight | 460.6 g/mol |
| Molecular Formula | C28H32N2O4 |
| Exact Mass | 460.236208 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K3kc4GADm1H |
|---|---|
| Name | 2,16-Didehydro-3-(benzoyloxy)-16-(methoxycarbonyl)-3,4-secoaspidospermidine(20.beta.,21.alpha.) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H32N2O4 |
| InChI | InChI=1S/C28H32N2O4/c1-3-27(14-9-17-34-24(31)19-10-5-4-6-11-19)18-20(25(32)33-2)23-28(15-16-29-26(27)28)21-12-7-8-13-22(21)30-23/h4-8,10-13,26,29-30H,3,9,14-18H2,1-2H3/t26-,27+,28-/m0/s1 |
| InChIKey | ZKQKZYVZGMHZJA-IARZGTGTSA-N |
| Molecular Weight | 460.574 g/mol |
| SMILES | N1CC[C@@]23C(=C(C[C@@]([C@]13[H])(CC)CCCOC(=O)c1ccccc1)C(=O)OC)Nc1ccccc21 |
| SPLASH | splash10-05i1-3920100000-b1205e70082813e2afdd |
| Source of Spectrum | J-58-1441-38 |
| Synonyms | (3aS,4R,11bR)-4-(3-Benzoyloxy-propyl)-4-ethyl-2,3,3a,4,5,7-hexahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylic acid methyl ester 2,16-Didehydro-3-(benzoyloxy)-16-(methoxycarbonyl)-3,4-secoaspidospermidine(20.alpha.,21.alpha.) Methyl (2Z,3S,8'R,8'aR)-2-[(benzoyloxy)methylidene]-8'-ethyl-8'-methyl-3',5',6',7',8',8'a,1,2-octahydro-2'H-spiro[indole-3,1'-indolizine]-6-carboxylate Methyl (3aS,4R,11bR)-4-(3-benzoyloxypropyl)-4-ethyl-1,2,3,3a,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Methyl (3aS,4R,11bR)-4-ethyl-4-[3-(phenylcarbonyloxy)propyl]-1,2,3,3a,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate |
| Wiley ID | 1390590 |