| SpectraBase Spectrum ID |
8aTZi9bX2ZK |
| Name |
[(1S,2S,5R,6S)-2-acetoxy-5-benzoyloxy-1,6-dihydroxy-cyclohex-3-en-1-yl]methyl benzoate |
| CAS Registry Number |
78804-18-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H22O8 |
| InChI |
InChI=1S/C23H22O8/c1-15(24)30-19-13-12-18(31-22(27)17-10-6-3-7-11-17)20(25)23(19,28)14-29-21(26)16-8-4-2-5-9-16/h2-13,18-20,25,28H,14H2,1H3/t18-,19+,20+,23-/m1/s1 |
| InChIKey |
WBFAMVDHSGIPNA-QTDGGUCWSA-N |
| Molecular Weight |
426.421 g/mol |
| SMILES |
O[C@@]1([C@]([C@](C=C[C@]1(OC(=O)c1ccccc1)[H])(OC(=O)C)[H])(COC(=O)c1ccccc1)O)[H] |
| SPLASH |
splash10-0a6r-2910000000-29831da3f62398848488 |
| Source of Spectrum |
J-46-4271-0 |
| Synonyms |
[(1S,2S,5R,6S)-2-acetyloxy-1,6-bis(oxidanyl)-5-(phenylcarbonyloxy)cyclohex-3-en-1-yl]methyl benzoate
[(1S,2S,5R,6S)-2-acetyloxy-5-benzoyloxy-1,6-dihydroxycyclohex-3-en-1-yl]methyl benzoate
benzoic acid [(1S,2S,5R,6S)-2-acetyloxy-5-benzoyloxy-1,6-dihydroxy-1-cyclohex-3-enyl]methyl ester |
| Wiley ID |
1379890 |
