| SpectraBase Spectrum ID |
9BZPd6aXiFb |
| Name |
1,3-Benzodioxole-5-carboxylic acid, 6-(4,5-dihydroxy-3,6-dioxo-1-cyclohexen-1-yl)-, methyl ester, cis-(.+-.)- |
| CAS Registry Number |
59167-14-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H12O8 |
| InChI |
InChI=1S/C15H12O8/c1-21-15(20)8-4-11-10(22-5-23-11)3-6(8)7-2-9(16)13(18)14(19)12(7)17/h2-4,13-14,18-19H,5H2,1H3/t13-,14+/m0/s1 |
| InChIKey |
QSTYKOUDUKHKHL-UONOGXRCSA-N |
| Molecular Weight |
320.253 g/mol |
| SMILES |
O[C@@]1(C(C(=CC([C@@]1(O)[H])=O)c1c(cc2c(c1)OCO2)C(=O)OC)=O)[H] |
| SPLASH |
splash10-001i-3392000000-d3cf912273286d509cf7 |
| Source of Spectrum |
W5-0-0-0 |
| Synonyms |
1,3-Benzodioxole-5-carboxylic acid, 6-(4,5-dihydroxy-3,6-dioxo-1-cyclohexen-1-yl)-, methyl ester, cis-(.+/-.)-
Methyl 6-[(4R,5S)-4,5-dihydroxy-3,6-dioxo-1-cyclohexen-1-yl]-1,3-benzodioxole-5-carboxylate |
| Wiley ID |
1319822 |
