(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid

SpectraBase Compound ID	HaZAhOP9Cqu
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 Google Search
Mol Weight	386.6 g/mol
Molecular Formula	C22H42O5
Exact Mass	386.303224 g/mol

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SpectraBase Spectrum ID	HAdR4yMsSDx
Name	(2S,3S,4R,6R)-2,4,6-Trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	386.303224447 u
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	C([C@]([C@]([C@@](C[C@@](CC)(C)[H])(C)[H])(O)[H])(C)[H])(O[C@]([C@@](C(=O)O)(C)[H])([C@@](C[C@@](CC)(C)[H])(C)[H])[H])=O