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Lobaric acid methylated dervative
SpectraBase Compound ID 3lXtyaSYqQH
InChI InChI=1S/C27H34O9/c1-6-8-10-11-17-23(26(31)34-4)20(29)15-21(30)25(17)36-22-14-16(33-3)13-18(19(28)12-9-7-2)24(22)27(32)35-5/h13-15,29-30H,6-12H2,1-5H3
InChIKey ANPVCUTYOTTXPT-UHFFFAOYSA-N
Mol Weight 502.6 g/mol
Molecular Formula C27H34O9
Exact Mass 502.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3ERcTGg0Ju
Name Lobaric acid methylated dervative
Alternate Name(s) 2-[3'-Methoxy-5'-pentanoyl-6'-(methoxycarbonyl)phenyl[-2'-[2''-hydroxy-4''-hydroxy-5''-(methoxycarbonyl)-6''-pentylphenyl]oxide 2-[3'-Methoxy-5'-pentanoyl-6'-(methoxycarbonyl)phenyl][2'-[2''-hydroxy-4''-hydroxy-5''-(methoxycarbonyl)-6''-pentylphenyl]oxide 2-[3'-Methoxy-5'-pentanoyl-6'-(methoxycarbonyl)phenyl[-2'-[2''-hydroxy-4''-hydroxy-5''-(methoxycarbonyl)-6''-pentylphenyl]oxide Lobaric acid methylated derivative Lobaric acid-dimethylated derivative
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Formula C27H34O9
InChI InChI=1S/C27H34O9/c1-6-8-10-11-17-23(26(31)34-4)20(29)15-21(30)25(17)36-22-14-16(33-3)13-18(19(28)12-9-7-2)24(22)27(32)35-5/h13-15,29-30H,6-12H2,1-5H3
InChIKey ANPVCUTYOTTXPT-UHFFFAOYSA-N
Molecular Weight 502.560 g/mol
SMILES Oc1cc(c(c(c1Oc1c(c(C(=O)CCCC)cc(c1)OC)C(=O)OC)CCCCC)C(=O)OC)O
SPLASH splash10-05g0-0118900000-f12a525726c58373f76e
Source of Spectrum Y4-91-465-4
Wiley ID 1550568