SpectraBase Spectrum ID |
DxFfbVYASw0 |
Name |
8-[(2R,3S,4S,6R)-6-hexyl-4-hydroxy-2-phenyl-3-oxanyl]octanoic acid methyl ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H42O4 |
InChI |
InChI=1S/C26H42O4/c1-3-4-5-12-17-22-20-24(27)23(26(30-22)21-15-10-9-11-16-21)18-13-7-6-8-14-19-25(28)29-2/h9-11,15-16,22-24,26-27H,3-8,12-14,17-20H2,1-2H3/t22-,23+,24+,26+/m1/s1 |
InChIKey |
PETHWBCBBVMYBE-APFRJGHOSA-N |
Molecular Weight |
418.618 g/mol |
SMILES |
O[C@@]1([C@@]([C@@](O[C@@](C1)(CCCCCC)[H])(c1ccccc1)[H])(CCCCCCCC(=O)OC)[H])[H] |
SPLASH |
splash10-0a4i-0910200000-13ecd8da575e6fe315d8 |
Source of Spectrum |
U1-0-2637-5 |
Synonyms |
8-[(2R,3S,4S,6R)-6-hexyl-4-hydroxy-2-phenyl-tetrahydropyran-3-yl]caprylic acid methyl ester
Methyl 8-[(2R,3S,4S,6R)-6-hexyl-4-hydroxy-2-phenyl-tetrahydropyran-3-yl]octanoate
Methyl 8-[(2R,3S,4S,6R)-6-hexyl-4-hydroxy-2-phenyloxan-3-yl]octanoate
Methyl 8-[(2R,3S,4S,6R)-6-hexyl-4-oxidanyl-2-phenyl-oxan-3-yl]octanoate |
Wiley ID |
1589956 |