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1,3,6-Trihydroxy-8-(6,7-epoxy-3,7-dimethyl-2-octenyl)-7-methoxyxanthone
SpectraBase Compound ID 9j6UXi4j3rl
InChI InChI=1S/C24H26O7/c1-12(6-8-19-24(2,3)31-19)5-7-14-20-18(11-16(27)23(14)29-4)30-17-10-13(25)9-15(26)21(17)22(20)28/h5,9-11,19,25-27H,6-8H2,1-4H3/b12-5+
InChIKey DOPKCWJTPHSJML-LFYBBSHMSA-N
Mol Weight 426.47 g/mol
Molecular Formula C24H26O7
Exact Mass 426.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wV4LXHbeTx
Name 1,3,6-Trihydroxy-8-(6,7-epoxy-3,7-dimethyl-2-octenyl)-7-methoxyxanthone
Alternate Name(s) 1-[(2E)-5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentenyl]-3,6,8-trihydroxy-2-methoxy-9H-xanthen-9-one 1-[(E)-5-(3,3-dimethyl-2-oxiranyl)-3-methylpent-2-enyl]-3,6,8-trihydroxy-2-methoxy-9-xanthenone 1-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enyl]-3,6,8-trihydroxy-2-methoxyxanthen-9-one 1-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methyl-pent-2-enyl]-3,6,8-trihydroxy-2-methoxy-xanthen-9-one 1-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methyl-pent-2-enyl]-2-methoxy-3,6,8-tris(oxidanyl)xanthen-9-one
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Formula C24H26O7
InChI InChI=1S/C24H26O7/c1-12(6-8-19-24(2,3)31-19)5-7-14-20-18(11-16(27)23(14)29-4)30-17-10-13(25)9-15(26)21(17)22(20)28/h5,9-11,19,25-27H,6-8H2,1-4H3/b12-5+
InChIKey DOPKCWJTPHSJML-LFYBBSHMSA-N
Molecular Weight 426.465 g/mol
SMILES Oc1cc2Oc3cc(c(c(c3C(c2c(c1)O)=O)C\C=C\(CCC1OC1(C)C)C)OC)O
SPLASH splash10-0002-0095100000-79fad2a150b396d5d165
Source of Spectrum E1-44-234-3
Wiley ID 1553357