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SZ-M4 [(7S,8S,R-biar)-6,7,8,9-tetrahydro-1,3,12,13,14-pentamethoxy-7,8-dimethyl-2,7,8-dibenzo[a,c]cyclooctenetriol]
SpectraBase Compound ID ApJCZDLcCQh
InChI InChI=1S/C23H30O8/c1-22(25)10-12-8-14(27-3)18(24)20(30-6)16(12)17-13(11-23(22,2)26)9-15(28-4)19(29-5)21(17)31-7/h8-9,24-26H,10-11H2,1-7H3/t22-,23+/m0/s1
InChIKey GQZMODZDCJYYSH-XZOQPEGZSA-N
Mol Weight 434.49 g/mol
Molecular Formula C23H30O8
Exact Mass 434.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42dP4CqBEG
Name SZ-M4 [(7S,8S,R-biar)-6,7,8,9-tetrahydro-1,3,12,13,14-pentamethoxy-7,8-dimethyl-2,7,8-dibenzo[a,c]cyclooctenetriol]
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Formula C23H30O8
InChI InChI=1S/C23H30O8/c1-22(25)10-12-8-14(27-3)18(24)20(30-6)16(12)17-13(11-23(22,2)26)9-15(28-4)19(29-5)21(17)31-7/h8-9,24-26H,10-11H2,1-7H3/t22-,23+/m0/s1
InChIKey GQZMODZDCJYYSH-XZOQPEGZSA-N
Molecular Weight 434.485 g/mol
SMILES Oc1c(c-2c(C[C@@]([C@@](Cc3cc(c(c(c23)OC)OC)OC)(O)C)(O)C)cc1OC)OC
SPLASH splash10-00kb-0009300000-3c5176b9e9f52402be7a
Source of Spectrum E1-43-128-7
Wiley ID 1552902