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Luffariolide A
SpectraBase Compound ID Cl1ui3SN0Nl
InChI InChI=1S/C25H36O3/c1-19(13-14-23-20(2)9-7-15-25(23,3)4)8-5-10-21(17-26)11-6-12-22-16-24(27)28-18-22/h6,8,11-12,16,26H,5,7,9-10,13-15,17-18H2,1-4H3/b12-6+,19-8+,21-11-
InChIKey KGFNALXSPUPYLU-USMVPROYSA-N
Mol Weight 384.6 g/mol
Molecular Formula C25H36O3
Exact Mass 384.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5k0dopOnKF
Name Luffariolide A
Alternate Name(s) 4-[(1E,3Z,7E)-4-(hydroxymethyl)-8-methyl-10-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,7-decatrienyl]-2(5H)-furanone
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Formula C25H36O3
InChI InChI=1S/C25H36O3/c1-19(13-14-23-20(2)9-7-15-25(23,3)4)8-5-10-21(17-26)11-6-12-22-16-24(27)28-18-22/h6,8,11-12,16,26H,5,7,9-10,13-15,17-18H2,1-4H3/b12-6+,19-8+,21-11-
InChIKey KGFNALXSPUPYLU-USMVPROYSA-N
Molecular Weight 384.560 g/mol
SMILES OC\C(=C/C=C/C1=CC(=O)OC1)CC\C=C\(CCC1=C(CCCC1(C)C)C)C
SPLASH splash10-000i-0900000000-f75db635a7a0863d5562
Source of Spectrum J-57-3506-1
Wiley ID 1361869