| SpectraBase Compound ID | ElcQnNA8oyj |
|---|---|
| InChI | InChI=1S/C24H28O9/c1-14-20(33-16(3)27)21(29)24(13-31-15(2)26)19(5-4-7-23(24)12-32-23)22(14,11-25)9-18(28)17-6-8-30-10-17/h6,8,10-11,14,19-20H,4-5,7,9,12-13H2,1-3H3/t14-,19-,20+,22-,23+,24+/m1/s1 |
| InChIKey | ZLHICZFHNLOYEB-VALAXESQSA-N |
| Mol Weight | 460.48 g/mol |
| Molecular Formula | C24H28O9 |
| Exact Mass | 460.173332 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GJE9cHYEm9l |
|---|---|
| Name | 7.alpha.,19-Diacetoxy-4.alpha.,18 : 15,16-diepoxy-6,12-dioxo-neocleroda-13(16),14-dien-20-al |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H28O9 |
| InChI | InChI=1S/C24H28O9/c1-14-20(33-16(3)27)21(29)24(13-31-15(2)26)19(5-4-7-23(24)12-32-23)22(14,11-25)9-18(28)17-6-8-30-10-17/h6,8,10-11,14,19-20H,4-5,7,9,12-13H2,1-3H3/t14-,19-,20+,22-,23+,24+/m1/s1 |
| InChIKey | ZLHICZFHNLOYEB-VALAXESQSA-N |
| Molecular Weight | 460.479 g/mol |
| SMILES | [C@@]12(C([C@@](OC(=O)C)([C@]([C@@]([C@]2(CCC[C@@]11OC1)[H])(CC(c1cocc1)=O)C=O)(C)[H])[H])=O)COC(=O)C |
| SPLASH | splash10-0gvk-5964000000-587783d7188dd56e40da |
| Source of Spectrum | G4-59-371-7 |
| Synonyms | Acetic acid [(4R,4aS,6S,7S,8S,8aR)-6-acetyloxy-8-formyl-8-[2-(3-furanyl)-2-oxoethyl]-7-methyl-5-oxo-4a-spiro[1,2,3,6,7,8a-hexahydronaphthalene-4,2'-oxirane]yl]methyl ester [(4R,4aS,6S,7S,8S,8aR)-6-acetyloxy-8-formyl-8-[2-(furan-3-yl)-2-oxoethyl]-7-methyl-5-oxospiro[1,2,3,6,7,8a-hexahydronaphthalene-4,2'-oxirane]-4a-yl]methyl acetate [(1S,2S,3S,4aS,5R,8aR)-3-acetoxy-1-formyl-1-[2-(3-furyl)-2-oxo-ethyl]-2-methyl-4-oxo-spiro[decalin-5,2'-oxirane]-4a-yl]methyl acetate [(4R,4aS,6S,7S,8S,8aR)-6-acetyloxy-8-[2-(furan-3-yl)-2-oxidanylidene-ethyl]-8-methanoyl-7-methyl-5-oxidanylidene-spiro[1,2,3,6,7,8a-hexahydronaphthalene-4,2'-oxirane]-4a-yl]methyl ethanoate |
| Wiley ID | 1606231 |