| SpectraBase Spectrum ID |
L5NYTU7Wsdo |
| Name |
(3S,4R)-3-Hydroxy-2,6-dimethyl-4-phenylsulfanyl-heptanoic acid 2,6-dimethyl-phenyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H30O3S |
| InChI |
InChI=1S/C23H30O3S/c1-15(2)14-20(27-19-12-7-6-8-13-19)21(24)18(5)23(25)26-22-16(3)10-9-11-17(22)4/h6-13,15,18,20-21,24H,14H2,1-5H3/t18?,20-,21+/m1/s1 |
| InChIKey |
AYRCUYPCNIVKSD-HBYOEVMUSA-N |
| Molecular Weight |
386.550 g/mol |
| SMILES |
O[C@]([C@](Sc1ccccc1)(CC(C)C)[H])(C(C(Oc1c(cccc1C)C)=O)C)[H] |
| SPLASH |
splash10-0avi-0970000000-63aedb046647e43c56b5 |
| Source of Spectrum |
KC-0-543-44 |
| Synonyms |
2,6-Dimethylphenyl (3S,4R)-3-hydroxy-2,6-dimethyl-4-(phenylsulfanyl)heptanoate
syn,anti-(2RS,3SR,4SR)-2,6-Dimethylphenyl 2,6-dimethyl-3-hydroxy-4-phenylsulfanylheptanoate |
| Wiley ID |
830010 |
