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(7R,8S,7'S,8'R)-1-(3,4,5,3',4')-PENTAMETHOXY-9,7'-DIHYDROXY-8,8',7-O-9'-LIGNAN
SpectraBase Compound ID 1RRftJTquiN
InChI InChI=1S/C23H30O8/c1-26-17-7-6-13(8-18(17)27-2)21(25)16-12-31-22(15(16)11-24)14-9-19(28-3)23(30-5)20(10-14)29-4/h6-10,15-16,21-22,24-25H,11-12H2,1-5H3/t15-,16+,21-,22+/m1/s1
InChIKey HIVHBYHHZGTBDZ-ZXJYCPGTSA-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 BqHjke8arLl
Name (7R,8S,7 'S,8 'R)-(3,4,5,3',4')-pentamethoxy-9,7'-dihydroxy-8.8',7.0.9'-lignan
Alternate Name(s) (S)-(3,4-Dimethoxy-phenyl)-[(3R,4S,5R)-4-hydroxymethyl-5-(3,4,5-trimethoxy-phenyl)-tetrahydro-furan-3-yl]-methanol (S)-(3,4-dimethoxyphenyl)-[(3R,4S,5R)-4-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-3-oxolanyl]methanol (S)-(3,4-dimethoxyphenyl)-[(3R,4S,5R)-4-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)tetrahydrofuran-3-yl]methanol (S)-(3,4-dimethoxyphenyl)-[(3R,4S,5R)-4-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)oxolan-3-yl]methanol
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Formula C23H30O8
InChI InChI=1S/C23H30O8/c1-26-17-7-6-13(8-18(17)27-2)21(25)16-12-31-22(15(16)11-24)14-9-19(28-3)23(30-5)20(10-14)29-4/h6-10,15-16,21-22,24-25H,11-12H2,1-5H3/t15-,16+,21-,22+/m1/s1
InChIKey HIVHBYHHZGTBDZ-ZXJYCPGTSA-N
Molecular Weight 434.485 g/mol
SMILES OC[C@@]1([C@@]([C@@](c2cc(OC)c(cc2)OC)(O)[H])(CO[C@]1(c1cc(OC)c(c(c1)OC)OC)[H])[H])[H]
SPLASH splash10-014r-0920200000-5e93b5d355d71fb8c322
Source of Spectrum E1-57-301-2
Wiley ID 1661727