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Met D [(7S,8R,R-biar)-6,7,8,9-tetrahydro-1,3,14-trimethoxy-12,13-methylenedioxy-7,8-dimethyl-2,7,8-dibebzo[a,c]cyclooctenetriol]
SpectraBase Compound ID 4mySRgSeN7u
InChI InChI=1S/C22H26O8/c1-21(24)8-11-6-13(26-3)17(23)19(27-4)15(11)16-12(9-22(21,2)25)7-14-18(20(16)28-5)30-10-29-14/h6-7,23-25H,8-10H2,1-5H3/t21-,22+/m1/s1
InChIKey NLAVWBUGPCZAFR-YADHBBJMSA-N
Mol Weight 418.44 g/mol
Molecular Formula C22H26O8
Exact Mass 418.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ON8t8JJRBl
Name Met D [(7S,8R,R-biar)-6,7,8,9-tetrahydro-1,3,14-trimethoxy-12,13-methylenedioxy-7,8-dimethyl-2,7,8-dibebzo[a,c]cyclooctenetriol]
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Formula C22H26O8
InChI InChI=1S/C22H26O8/c1-21(24)8-11-6-13(26-3)17(23)19(27-4)15(11)16-12(9-22(21,2)25)7-14-18(20(16)28-5)30-10-29-14/h6-7,23-25H,8-10H2,1-5H3/t21-,22+/m1/s1
InChIKey NLAVWBUGPCZAFR-YADHBBJMSA-N
Molecular Weight 418.442 g/mol
SMILES Oc1c(c-2c(C[C@]([C@](Cc3cc4OCOc4c(c23)OC)(O)C)(O)C)cc1OC)OC
SPLASH splash10-0udl-6000900000-403b6c36e7c63285ffc0
Source of Spectrum E1-38-140-5
Wiley ID 1518179