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Scutellaprostin B

View entire compound with spectra: 1 MS (GC)

Scutellaprostin B
SpectraBase Compound ID 6WuhDsPUt3W
InChI InChI=1S/C25H20O9/c1-31-19-8-13(4-7-15(19)28)23-21(11-26)34-24-20(33-23)10-17(30)22-16(29)9-18(32-25(22)24)12-2-5-14(27)6-3-12/h2-10,21,23,26-28,30H,11H2,1H3/t21-,23-/m1/s1
InChIKey OJUFMXZXXZASBJ-FYYLOGMGSA-N
Mol Weight 464.43 g/mol
Molecular Formula C25H20O9
Exact Mass 464.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qqG4irMltr
Name Scutellaprostin B
Alternate Name(s) (2R,3R)-6-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-9-(4-hydroxyphenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one (2R,3R)-6-hydroxy-3-(4-hydroxy-3-methoxy-phenyl)-2-(hydroxymethyl)-9-(4-hydroxyphenyl)-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one (2R,3R)-2-(hydroxymethyl)-9-(4-hydroxyphenyl)-3-(3-methoxy-4-oxidanyl-phenyl)-6-oxidanyl-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one
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Formula C25H20O9
InChI InChI=1S/C25H20O9/c1-31-19-8-13(4-7-15(19)28)23-21(11-26)34-24-20(33-23)10-17(30)22-16(29)9-18(32-25(22)24)12-2-5-14(27)6-3-12/h2-10,21,23,26-28,30H,11H2,1H3/t21-,23-/m1/s1
InChIKey OJUFMXZXXZASBJ-FYYLOGMGSA-N
Molecular Weight 464.426 g/mol
SMILES Oc1ccc(C2=CC(c3c(c4c(O[C@](c5ccc(c(c5)OC)O)([C@](O4)(CO)[H])[H])cc3O)O2)=O)cc1
SPLASH splash10-000i-0930100000-58f10a469c2eeddd7927
Source of Spectrum E1-39-1470-0
Wiley ID 1518857