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5'-pentylbenzene-1',3'-diyl bis(2,4-dihydroxy-6-pentylbenzoate)
SpectraBase Compound ID GUEXexA2fAl
InChI InChI=1S/C35H44O8/c1-4-7-10-13-23-16-28(42-34(40)32-24(14-11-8-5-2)18-26(36)20-30(32)38)22-29(17-23)43-35(41)33-25(15-12-9-6-3)19-27(37)21-31(33)39/h16-22,36-39H,4-15H2,1-3H3
InChIKey VTNHTXKYXLPXSP-UHFFFAOYSA-N
Mol Weight 592.7 g/mol
Molecular Formula C35H44O8
Exact Mass 592.303618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6m5TVaKZnIB
Name 5'-pentylbenzene-1',3'-diyl bis(2,4-dihydroxy-6-pentylbenzoate)
Alternate Name(s) 3-[(2,4-dihydroxy-6-pentylbenzoyl)oxy]-5-pentylphenyl 2,4-dihydroxy-6-pentylbenzoate Depsidellin B
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Formula C35H44O8
InChI InChI=1S/C35H44O8/c1-4-7-10-13-23-16-28(42-34(40)32-24(14-11-8-5-2)18-26(36)20-30(32)38)22-29(17-23)43-35(41)33-25(15-12-9-6-3)19-27(37)21-31(33)39/h16-22,36-39H,4-15H2,1-3H3
InChIKey VTNHTXKYXLPXSP-UHFFFAOYSA-N
Molecular Weight 592.729 g/mol
SMILES Oc1cc(c(C(Oc2cc(OC(c3c(cc(cc3CCCCC)O)O)=O)cc(c2)CCCCC)=O)c(c1)CCCCC)O
SPLASH splash10-0ab9-0970000000-b28d878db5c1999fcec0
Source of Spectrum JA-50-1145-0
Wiley ID 1409518