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3,7,4'-Triihydroxy-3'-(8"-acetoxy-7"-methyloctyl)-5,6-dimethoxyflavone
SpectraBase Compound ID 7W3r50S3n2T
InChI InChI=1S/C28H34O9/c1-16(15-36-17(2)29)9-7-5-6-8-10-18-13-19(11-12-20(18)30)26-25(33)24(32)23-22(37-26)14-21(31)27(34-3)28(23)35-4/h11-14,16,30-31,33H,5-10,15H2,1-4H3
InChIKey PEZYILOZNWLRTK-UHFFFAOYSA-N
Mol Weight 514.6 g/mol
Molecular Formula C28H34O9
Exact Mass 514.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ipw81kOhZ6f
Name 3,7,4'-Triihydroxy-3'-(8"-acetoxy-7"-methyloctyl)-5,6-dimethoxyflavone
Alternate Name(s) Acetic acid [8-[5-(3,7-dihydroxy-5,6-dimethoxy-4-oxo-1-benzopyran-2-yl)-2-hydroxyphenyl]-2-methyloctyl] ester [8-[5-(3,7-dihydroxy-5,6-dimethoxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-2-methyloctyl] acetate [8-[5-(3,7-dihydroxy-5,6-dimethoxy-4-oxo-chromen-2-yl)-2-hydroxy-phenyl]-2-methyl-octyl] acetate [8-[5-[5,6-dimethoxy-3,7-bis(oxidanyl)-4-oxidanylidene-chromen-2-yl]-2-oxidanyl-phenyl]-2-methyl-octyl] ethanoate
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Formula C28H34O9
InChI InChI=1S/C28H34O9/c1-16(15-36-17(2)29)9-7-5-6-8-10-18-13-19(11-12-20(18)30)26-25(33)24(32)23-22(37-26)14-21(31)27(34-3)28(23)35-4/h11-14,16,30-31,33H,5-10,15H2,1-4H3
InChIKey PEZYILOZNWLRTK-UHFFFAOYSA-N
Molecular Weight 514.571 g/mol
SMILES OC=1C(c2c(c(c(cc2OC1c1cc(CCCCCCC(COC(=O)C)C)c(cc1)O)O)OC)OC)=O
SPLASH splash10-03kc-0394700000-4f2536512bc63d46face
Source of Spectrum E2-52-788-3
Wiley ID 1556535