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SZ-MD2 [(7S,8R,R-biar)-6,7,8,9-tetrahydro-1,2,3,12,14-pentamethoxy-7,8-dimethyl-7,813-dibenzo[a,c]cyclooctenetriol]
SpectraBase Compound ID D9nNQcpFFhN
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+/m1/s1
InChIKey GQZMODZDCJYYSH-PKTZIBPZSA-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 2BElllAZWq
Name SZ-MD2 [(7S,8R,R-biar)-6,7,8,9-tetrahydro-1,2,3,12,14-pentamethoxy-7,8-dimethyl-7,813-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+/m1/s1
InChIKey GQZMODZDCJYYSH-PKTZIBPZSA-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 splash10-0005-0019200000-2f4e099bea104efbfc00
Source of Spectrum E1-43-129-14
Wiley ID 1552890