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Scutellaprostin A

View entire compound with spectra: 1 MS (GC)

Scutellaprostin A
SpectraBase Compound ID FWnA9Y49NLS
InChI InChI=1S/C25H20O8/c1-30-19-9-14(7-8-15(19)27)23-21(12-26)33-24-20(32-23)11-17(29)22-16(28)10-18(31-25(22)24)13-5-3-2-4-6-13/h2-11,21,23,26-27,29H,12H2,1H3/t21-,23-/m1/s1
InChIKey FECLWLKPCOCFKF-FYYLOGMGSA-N
Mol Weight 448.43 g/mol
Molecular Formula C25H20O8
Exact Mass 448.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4W1AW1l8JNQ
Name Scutellaprostin A
Alternate Name(s) (2R,3R)-6-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-9-phenyl-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one (2R,3R)-6-hydroxy-3-(4-hydroxy-3-methoxy-phenyl)-2-(hydroxymethyl)-9-phenyl-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one (2R,3R)-2-(hydroxymethyl)-3-(3-methoxy-4-oxidanyl-phenyl)-6-oxidanyl-9-phenyl-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-7-one
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Formula C25H20O8
InChI InChI=1S/C25H20O8/c1-30-19-9-14(7-8-15(19)27)23-21(12-26)33-24-20(32-23)11-17(29)22-16(28)10-18(31-25(22)24)13-5-3-2-4-6-13/h2-11,21,23,26-27,29H,12H2,1H3/t21-,23-/m1/s1
InChIKey FECLWLKPCOCFKF-FYYLOGMGSA-N
Molecular Weight 448.427 g/mol
SMILES Oc1c2c(c3c(O[C@](c4ccc(c(c4)OC)O)([C@](O3)(CO)[H])[H])c1)OC(=CC2=O)c1ccccc1
SPLASH splash10-00ej-0920400000-1f9507950ae8d9102a58
Source of Spectrum E1-39-1469-1
Wiley ID 1518860