![(1R,3R,4R)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-quinone](/api/spectrum/1Yr5x4VKYFk/structure.png?h=300&w=458 "(1R,3R,4R)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-quinone")
| SpectraBase Compound ID | DyrBpASFM4t |
|---|---|
| InChI | InChI=1S/C15H14O6/c1-5-10-12(13(18)6(2)21-5)14(19)8-3-7(16)4-9(17)11(8)15(10)20/h3-6,13,16-18H,1-2H3/t5-,6-,13+/m1/s1 |
| InChIKey | LJEROUHPDCFEGJ-HCLRGFLGSA-N |
| Mol Weight | 290.27 g/mol |
| Molecular Formula | C15H14O6 |
| Exact Mass | 290.079038 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Yr5x4VKYFk |
|---|---|
| Name | (1R,3R,4R)-1,3-dimethyl-4,7,9-tris(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione |
| CAS Registry Number | 119182-20-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H14O6 |
| InChI | InChI=1S/C15H14O6/c1-5-10-12(13(18)6(2)21-5)14(19)8-3-7(16)4-9(17)11(8)15(10)20/h3-6,13,16-18H,1-2H3/t5-,6-,13+/m1/s1 |
| InChIKey | LJEROUHPDCFEGJ-HCLRGFLGSA-N |
| Molecular Weight | 290.271 g/mol |
| SMILES | Oc1cc2C(C3=C(C(c2c(c1)O)=O)[C@](O[C@@]([C@@]3(O)[H])(C)[H])(C)[H])=O |
| SPLASH | splash10-00kb-0090000000-ddc567579b04138053d2 |
| Source of Spectrum | KC-1988-2476-2 |
| Synonyms | (1R,3R,4R)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione Quinone A' (1R,3R,4R)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g][2]benzopyran-5,10-dione (1R,3R,4R)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benz[g]isochromene-5,10-quinone (1R,3R,4R)-3,4-Dihydro-4,7,9-trihydroxy-1,3-dimethylnaphtho[2,3-c]pyran-5,10-quinone |
| Wiley ID | 1293406 |