| SpectraBase Spectrum ID |
Kcs83EsE443 |
| Name |
2-((3S,4S)-4-Hydroxy-5-tetradecyl-tetrahydro-furan-3-yl)-4-p-tolylsulfanyl-isoindole-1,3-dione |
| Alternate Name(s) |
1-(3-Hydroxy-2-tetradecyltetrahydrofuran-4-yl)-4-(p-methylphenylthio)-1H,3H-isoindole-1,3-dione
2-[(3S,4S)-4-hydroxy-5-tetradecyltetrahydro-3-furanyl]-4-[(4-methylphenyl)sulfanyl]-1H-isoindole-1,3(2H)-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H45NO4S |
| InChI |
InChI=1S/C33H45NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-28-31(35)27(23-38-28)34-32(36)26-16-15-18-29(30(26)33(34)37)39-25-21-19-24(2)20-22-25/h15-16,18-22,27-28,31,35H,3-14,17,23H2,1-2H3/t27-,28?,31-/m0/s1 |
| InChIKey |
KLDOPWDIBCFUKY-ZVQFGFPDSA-N |
| Molecular Weight |
551.786 g/mol |
| SMILES |
O[C@]1([C@@](N2C(c3c(Sc4ccc(cc4)C)cccc3C2=O)=O)(COC1CCCCCCCCCCCCCC)[H])[H] |
| SPLASH |
splash10-014i-0090030000-42197a17ea42937ceeff |
| Source of Spectrum |
H1-55-1130-3 |
| Wiley ID |
1564540 |
