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SACIDUMLIGNAN_C;REL-(7-ALPHA,8-BETA,7'-ALPHA,8'-BETA)-5,7,4'-TRIHYDROXY-4,6,3',5'-TETRAMETHOXY-8,8'-EPOXY-2,7'-CYClOLIGNAN

View entire compound with spectra: 1 NMR, and 1 MS (GC)

SACIDUMLIGNAN_C;REL-(7-ALPHA,8-BETA,7'-ALPHA,8'-BETA)-5,7,4'-TRIHYDROXY-4,6,3',5'-TETRAMETHOXY-8,8'-EPOXY-2,7'-CYClOLIGNAN
SpectraBase Compound ID FHT4y6rFSn2
InChI InChI=1S/C22H26O8/c1-21-16(10-7-12(26-3)17(23)13(8-10)27-4)11-9-14(28-5)18(24)19(29-6)15(11)20(25)22(21,2)30-21/h7-9,16,20,23-25H,1-6H3/t16-,20+,21-,22+/m0/s1
InChIKey KFJQDOGRKGBSSL-HAFPXEGZSA-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 1FlpEzTnPho
Name Sacidumlignan C
Alternate Name(s) 2,3-Dimethyl-5,8-dimethoxy-4-(3',5'-dimethoxy-4'-hydroxyphenyl)-1,7-dihydroxy-2,3-epoxy-3,4-dihydronaphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O8
InChI InChI=1S/C22H26O8/c1-21-16(10-7-12(26-3)17(23)13(8-10)27-4)11-9-14(28-5)18(24)19(29-6)15(11)20(25)22(21,2)30-21/h7-9,16,20,23-25H,1-6H3/t16-,20+,21-,22+/m0/s1
InChIKey KFJQDOGRKGBSSL-HAFPXEGZSA-N
Molecular Weight 418.442 g/mol
SMILES Oc1c(cc2c([C@]([C@@]3([C@]([C@]2(c2cc(c(c(c2)OC)O)OC)[H])(O3)C)C)(O)[H])c1OC)OC
SPLASH splash10-066r-0014900000-02a0874b18a0a7b7794e
Source of Spectrum X2-68-225-3
Wiley ID 1609428