| SpectraBase Compound ID | 1UUNCrM6JZb |
|---|---|
| InChI | InChI=1S/C19H18O8/c1-8-5-12(21)11(7-20)17(23)15(8)19(25)27-13-6-9(2)14(18(24)26-4)16(22)10(13)3/h5-7,21-23H,1-4H3 |
| InChIKey | YLOYKYXNDHOHHT-UHFFFAOYSA-N |
| Mol Weight | 374.35 g/mol |
| Molecular Formula | C19H18O8 |
| Exact Mass | 374.100168 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HbBCyZqvv2T |
|---|---|
| Name | dissectic acid |
| CAS Registry Number | 479-20-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H18O8 |
| InChI | InChI=1S/C19H18O8/c1-8-5-12(21)11(7-20)17(23)15(8)19(25)27-13-6-9(2)14(18(24)26-4)16(22)10(13)3/h5-7,21-23H,1-4H3 |
| InChIKey | YLOYKYXNDHOHHT-UHFFFAOYSA-N |
| Molecular Weight | 374.345 g/mol |
| SMILES | Oc1c(c(OC(c2c(c(c(cc2C)O)C=O)O)=O)cc(c1C(=O)OC)C)C |
| SPLASH | splash10-0002-0901000000-c1703a7171a44e4920c3 |
| Source of Spectrum | G4-70-318-5 |
| Synonyms | Atranoric acid Benzoic acid, 3-formyl-2,4-dihydroxy-6-methyl-, 3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester Atranorin Isophthalaldehydic acid, 2,4-dihydroxy-6-methyl-, 4-ester with methyl 3,6-dimethyl-.beta.-resorcylate 3-formyl-2,4-dihydroxy-6-methylbenzoic acid (3-hydroxy-4-methoxycarbonyl-2,5-dimethylphenyl) ester (3-hydroxy-4-methoxycarbonyl-2,5-dimethyl-phenyl) 3-formyl-2,4-dihydroxy-6-methyl-benzoate 3-Hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl 3-formyl-2,4-dihydroxy-6-methylbenzoate (4-methoxycarbonyl-2,5-dimethyl-3-oxidanyl-phenyl) 3-methanoyl-6-methyl-2,4-bis(oxidanyl)benzoate 3-formyl-2,4-dihydroxy-6-methyl-benzoic acid (4-carbomethoxy-3-hydroxy-2,5-dimethyl-phenyl) ester (3-hydroxy-4-methoxycarbonyl-2,5-dimethylphenyl) 3-formyl-2,4-dihydroxy-6-methylbenzoate Antranoric acid Atranorine Parmelin Parmelin acid Usnarin Usnarin acid EINECS 207-527-7 NSC 249980 NSC 685591 |
| Wiley ID | 1694867 |