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Diacetyl-combretastatin A
SpectraBase Compound ID n4fY7yiGLV
InChI InChI=1S/C22H24O8/c1-13(23)29-20-16(9-10-17(25-3)22(20)30-14(2)24)8-7-15-11-18(26-4)21(28-6)19(12-15)27-5/h7-12H,1-6H3/b8-7+
InChIKey WKBAIQKBJAZKOF-BQYQJAHWSA-N
Mol Weight 416.43 g/mol
Molecular Formula C22H24O8
Exact Mass 416.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyeNzIgmlAM
Name Diacetyl-combretastatin A
Alternate Name(s) 2',3'-Diacetoxy-4'-methoxy-(E)-Combretastatin A 1-(3',4',5'-Trimethoxyphenyl)-2-(2'',3''-diacetoxy-4''-methoxyphenyl)-ethene 2-(acetyloxy)-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl acetate Acetic acid[2-acetoxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl]ester Acetic acid [2-acetyloxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] ester Acetic acid[2-acetyloxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]ester [2-acetyloxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] acetate [2-acetoxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl]acetate [2-acetoxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl] acetate [2-acetyloxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]ethanoate [2-acetyloxy-3-methoxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] ethanoate
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Formula C22H24O8
InChI InChI=1S/C22H24O8/c1-13(23)29-20-16(9-10-17(25-3)22(20)30-14(2)24)8-7-15-11-18(26-4)21(28-6)19(12-15)27-5/h7-12H,1-6H3/b8-7+
InChIKey WKBAIQKBJAZKOF-BQYQJAHWSA-N
Molecular Weight 416.426 g/mol
SMILES c1(c(OC(=O)C)c(\C=C\c2cc(OC)c(c(c2)OC)OC)ccc1OC)OC(=O)C
SPLASH splash10-00si-0009400000-998652088ffe03bee6e4
Source of Spectrum X2-50-126-1
Wiley ID 1602184