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Ceratioflavine A

View entire compound with spectra: 1 MS (GC)

Ceratioflavine A
SpectraBase Compound ID HR9YSsJT9iA
InChI InChI=1S/C23H26O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-22(25-2)20-23(24)26-21/h3-4,7-20H,5-6H2,1-2H3/b4-3+,8-7+,10-9+,12-11+,14-13+,16-15+,18-17+
InChIKey OKPDDZOFQVFXCZ-IFKNUABHSA-N
Mol Weight 350.46 g/mol
Molecular Formula C23H26O3
Exact Mass 350.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37kaXCj1W4
Name Ceratioflavine A
Alternate Name(s) 6-(Heptadeca-1',3',5',7',9',11',15'-heptaenyl)-4-methoxypyran-2-one 6-[(1E,3E,5E,7E,9E,11E,15E)-1,3,5,7,9,11,15-heptadecaheptaenyl]-4-methoxy-2H-pyran-2-one
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Formula C23H26O3
InChI InChI=1S/C23H26O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-22(25-2)20-23(24)26-21/h3-4,7-20H,5-6H2,1-2H3/b4-3+,8-7+,10-9+,12-11+,14-13+,16-15+,18-17+
InChIKey OKPDDZOFQVFXCZ-IFKNUABHSA-N
Molecular Weight 350.458 g/mol
SMILES C=1C(OC(=CC1OC)\C=C\C=C\C=C\C=C\C=C\C=C\CC\C=C\C)=O
SPLASH splash10-0ufr-2918000000-728d94ac4b625e6ea922
Source of Spectrum U-1995-85-5
Wiley ID 766378