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GARCIDEPSIDONE-B
SpectraBase Compound ID 7K6s21DnoSt
InChI InChI=1S/C28H32O7/c1-15(2)7-6-8-17(5)10-12-18-20(29)13-22-24(26(18)32)28(33)35-27-19(11-9-16(3)4)25(31)21(30)14-23(27)34-22/h7,9-10,13-14,29-32H,6,8,11-12H2,1-5H3/b17-10+
InChIKey LPILTZUCZVFKIO-LICLKQGHSA-N
Mol Weight 480.6 g/mol
Molecular Formula C28H32O7
Exact Mass 480.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JI45gjpVt6
Name 8-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,3,7,9-tetrahydroxy-4-(3-methylbut-2-enyl)-6-benzo[b][1,4]benzodioxepinone
Alternate Name(s) 8-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,3,7,9-tetrahydroxy-4-(3-methylbut-2-enyl)benzo[b][1,4]benzodioxepin-6-one 8-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-(3-methylbut-2-enyl)-2,3,7,9-tetrakis(oxidanyl)benzo[b][1,4]benzodioxepin-6-one
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Formula C28H32O7
InChI InChI=1S/C28H32O7/c1-15(2)7-6-8-17(5)10-12-18-20(29)13-22-24(26(18)32)28(33)35-27-19(11-9-16(3)4)25(31)21(30)14-23(27)34-22/h7,9-10,13-14,29-32H,6,8,11-12H2,1-5H3/b17-10+
InChIKey LPILTZUCZVFKIO-LICLKQGHSA-N
Molecular Weight 480.557 g/mol
SMILES Oc1c(c2OC(c3c(c(c(cc3Oc2cc1O)O)C\C=C\(CCC=C(C)C)C)O)=O)CC=C(C)C
SPLASH splash10-0m60-0007900000-e0032c713f218109b33f
Source of Spectrum G4-63-1363-2
Wiley ID 1608643