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Luffariolide E
SpectraBase Compound ID GB9FCKHbOt
InChI InChI=1S/C25H36O4/c1-17(10-12-21-18(2)8-6-14-25(21,3)4)7-5-9-19-11-13-22(29-24(19)27)20-15-23(26)28-16-20/h7,11,20,22H,5-6,8-10,12-16H2,1-4H3/b17-7+/t20-,22-/m1/s1
InChIKey RRCWZZNUUYHHOI-GOQBNCRASA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EGHSt5mgIt
Name Luffariolide E
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-17(10-12-21-18(2)8-6-14-25(21,3)4)7-5-9-19-11-13-22(29-24(19)27)20-15-23(26)28-16-20/h7,11,20,22H,5-6,8-10,12-16H2,1-4H3/b17-7+/t20-,22-/m1/s1
InChIKey RRCWZZNUUYHHOI-GOQBNCRASA-N
Molecular Weight 400.559 g/mol
SMILES C1(O[C@]([C@@]2(CC(=O)OC2)[H])([H])CC=C1CC\C=C\(CCC1=C(CCCC1(C)C)C)C)=O
SPLASH splash10-000i-0900000000-7ee589f7de861b128d22
Source of Spectrum J-57-3506-5
Synonyms (6R)-3-[(3E)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-hexenyl]-6-[(3R)-5-oxotetrahydro-3-furanyl]-5,6-dihydro-2H-pyran-2-one (2R)-5-[(E)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexenyl)hex-3-enyl]-2-[(3R)-5-oxo-3-oxolanyl]-2,3-dihydropyran-6-one (2R)-5-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-2-[(3R)-5-oxooxolan-3-yl]-2,3-dihydropyran-6-one (2R)-5-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-2-[(3R)-5-oxotetrahydrofuran-3-yl]-2,3-dihydropyran-6-one (2R)-5-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-2-[(3R)-5-oxidanylideneoxolan-3-yl]-2,3-dihydropyran-6-one
Wiley ID 1369598