| SpectraBase Spectrum ID |
A8vAMqNL9so |
| Name |
(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H42O5 |
| InChI |
InChI=1S/C22H42O5/c1-9-13(3)11-15(5)19(23)17(7)22(26)27-20(18(8)21(24)25)16(6)12-14(4)10-2/h13-20,23H,9-12H2,1-8H3,(H,24,25)/t13-,14-,15-,16-,17+,18+,19+,20+/m1/s1 |
| InChIKey |
ZQEUMOKDJCSNHB-IHRHECOVSA-N |
| Molecular Weight |
386.573 g/mol |
| SMILES |
O[C@]([C@@](C(O[C@]([C@@](C(=O)O)(C)[H])([C@@](C[C@@](CC)(C)[H])(C)[H])[H])=O)(C)[H])([C@@](C[C@@](CC)(C)[H])(C)[H])[H] |
| SPLASH |
splash10-00kr-4900000000-9b383bcedc1640f60855 |
| Source of Spectrum |
J-59-3358-1 |
| Synonyms |
(2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyl-1-oxooctoxy]-2,4,6-trimethyloctanoic acid
(2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyl-octanoyl]oxy-2,4,6-trimethyl-caprylic acid
(2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyloctanoyl]oxy-2,4,6-trimethyloctanoic acid |
| Wiley ID |
1362760 |
![(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid](/api/spectrum/A8vAMqNL9so/structure.png?h=300&w=458 "(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid")
