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Luffariolide D
SpectraBase Compound ID Ey6hCIC7TY7
InChI InChI=1S/C25H38O4/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/h7,11,20,22,24,27H,5-6,8-10,12-16H2,1-4H3/b17-7+/t20-,22-,24?/m1/s1
InChIKey AIPOJIGVVVFLQI-MMHQBXSCSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24qMlorXmli
Name Luffariolide D
Alternate Name(s) (4R)-4-[(2R)-6-hydroxy-5-[(E)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexenyl)hex-3-enyl]-3,6-dihydro-2H-pyran-2-yl]-2-oxolanone (4R)-4-[(2R)-6-hydroxy-5-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-3,6-dihydro-2H-pyran-2-yl]oxolan-2-one (4R)-4-[(2R)-5-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-6-oxidanyl-3,6-dihydro-2H-pyran-2-yl]oxolan-2-one
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Formula C25H38O4
InChI InChI=1S/C25H38O4/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/h7,11,20,22,24,27H,5-6,8-10,12-16H2,1-4H3/b17-7+/t20-,22-,24?/m1/s1
InChIKey AIPOJIGVVVFLQI-MMHQBXSCSA-N
Molecular Weight 402.575 g/mol
SMILES OC1O[C@](CC=C1CC\C=C\(CCC1=C(CCCC1(C)C)C)C)([C@@]1(CC(=O)OC1)[H])[H]
SPLASH splash10-000i-0900000000-dd2c2e954ac10caad1af
Source of Spectrum J-57-3506-4
Wiley ID 1370575