| SpectraBase Spectrum ID |
BQkF7goOQ8D |
| Name |
2-Methoxy-6-[5-[2-[(2S)-2-oxidanylpropyl]-1,3-dithian-2-yl]pentyl]-4-phenylmethoxy-benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O5S2 |
| InChI |
InChI=1S/C27H36O5S2/c1-20(28)18-27(33-14-9-15-34-27)13-8-4-7-12-22-16-23(17-24(31-2)25(22)26(29)30)32-19-21-10-5-3-6-11-21/h3,5-6,10-11,16-17,20,28H,4,7-9,12-15,18-19H2,1-2H3,(H,29,30)/t20-/m0/s1 |
| InChIKey |
VLCZFQXBKIDURB-FQEVSTJZSA-N |
| Molecular Weight |
504.700 g/mol |
| SMILES |
O[C@](CC1(CCCCCc2cc(cc(c2C(=O)O)OC)OCc2ccccc2)SCCCS1)(C)[H] |
| SPLASH |
splash10-0006-9101000000-4db0a3049db22f7515f5 |
| Source of Spectrum |
KC-0-2620-10 |
| Synonyms |
2-[5-[2-[(2S)-2-hydroxypropyl]-1,3-dithian-2-yl]pentyl]-6-methoxy-4-phenylmethoxybenzoic acid
4-Benzoxy-2-[5-[2-[(2S)-2-hydroxypropyl]-1,3-dithian-2-yl]pentyl]-6-methoxy-benzoic acid |
| Wiley ID |
786710 |
![2-Methoxy-6-[5-[2-[(2S)-2-oxidanylpropyl]-1,3-dithian-2-yl]pentyl]-4-phenylmethoxy-benzoic acid](/api/spectrum/BQkF7goOQ8D/structure.png?h=300&w=458 "2-Methoxy-6-[5-[2-[(2S)-2-oxidanylpropyl]-1,3-dithian-2-yl]pentyl]-4-phenylmethoxy-benzoic acid")
