| SpectraBase Compound ID | 4Sipn2L2ZPn |
|---|---|
| InChI | InChI=1S/C17H20O6/c1-8-13-12(22-9(2)19)6-17(3,21)11-5-4-10(7-18)14(11)15(13)23-16(8)20/h4,7,11-15,21H,1,5-6H2,2-3H3/t11?,12-,13+,14?,15-,17+/m0/s1 |
| InChIKey | RDRXRSKXVGDNHJ-DDRDWXHXSA-N |
| Mol Weight | 320.34 g/mol |
| Molecular Formula | C17H20O6 |
| Exact Mass | 320.125988 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 222Ng78hBik |
|---|---|
| Name | .delta.-3(4)-8.alpha.-O-acetyl-15-oxoflabellin |
| Alternate Name(s) | Acetic acid [(3aR,4S,6R,9bR)-9-formyl-6-hydroxy-6-methyl-3-methylene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] ester [(3aR,4S,6R,9bR)-9-formyl-6-hydroxy-6-methyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] acetate [(3aR,4S,6R,9bR)-9-formyl-6-hydroxy-6-methyl-3-methylene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] acetate [(3aR,4S,6R,9bR)-9-methanoyl-6-methyl-3-methylidene-6-oxidanyl-2-oxidanylidene-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H20O6 |
| InChI | InChI=1S/C17H20O6/c1-8-13-12(22-9(2)19)6-17(3,21)11-5-4-10(7-18)14(11)15(13)23-16(8)20/h4,7,11-15,21H,1,5-6H2,2-3H3/t11?,12-,13+,14?,15-,17+/m0/s1 |
| InChIKey | RDRXRSKXVGDNHJ-DDRDWXHXSA-N |
| Molecular Weight | 320.341 g/mol |
| SMILES | O[C@]1(C2C([C@@]3([C@](C(=C)C(O3)=O)([C@](C1)(OC(=O)C)[H])[H])[H])C(=CC2)C=O)C |
| SPLASH | splash10-00r2-6940000000-4d7f99bdb61defe4dd94 |
| Source of Spectrum | G4-61-562-3 |
| Wiley ID | 1607200 |