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3-Methyl-14,15-dihydro-15-hydroxy-Teretifolione B
SpectraBase Compound ID Yz4aNC3e3e
InChI InChI=1S/C21H24O5/c1-12-17(22)14-6-7-15-13(16(14)19(24)18(12)23)8-11-21(4,26-15)10-5-9-20(2,3)25/h6-8,11,23,25H,5,9-10H2,1-4H3/t21-/m1/s1
InChIKey OFIJEJBWMQKPPA-OAQYLSRUSA-N
Mol Weight 356.42 g/mol
Molecular Formula C21H24O5
Exact Mass 356.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsTPotAIjMR
Name 3-Methyl-14,15-dihydro-15-hydroxy-Teretifolione B
Alternate Name(s) (R)-9-Hydroxy-3-(4'-hydroxy-4'-methyl-pentan-1'-yl)-3,8-dimethyl-3H-naphtho[1,2-b]pyran-7,10-dione (+)-Brachiphyllone (3R)-9-hydroxy-3-(4-hydroxy-4-methylpentyl)-3,8-dimethyl-3H-benzo[f]chromene-7,10-dione 9-Hydroxy-3-(4'-hydroxy-4'-methylpentan-1'-yl0-3,8-dimethyl-3H-naphtho[1,2-b]pyran-7,10-dione
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Formula C21H24O5
InChI InChI=1S/C21H24O5/c1-12-17(22)14-6-7-15-13(16(14)19(24)18(12)23)8-11-21(4,26-15)10-5-9-20(2,3)25/h6-8,11,23,25H,5,9-10H2,1-4H3/t21-/m1/s1
InChIKey OFIJEJBWMQKPPA-OAQYLSRUSA-N
Molecular Weight 356.418 g/mol
SMILES OC(CCC[C@]1(Oc2c(c3c(C(C(=C(C3=O)O)C)=O)cc2)C=C1)C)(C)C
SPLASH splash10-0a4i-0090000000-69b8bf1f41879b853f25
Source of Spectrum B-52-60-2
Wiley ID 746276