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meso-3,5-Diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
SpectraBase Compound ID HaZurUmtNR1
InChI InChI=1S/C25H32O8/c1-16(26)32-20(9-5-18-7-11-22(28)24(13-18)30-3)15-21(33-17(2)27)10-6-19-8-12-23(29)25(14-19)31-4/h7-8,11-14,20-21,28-29H,5-6,9-10,15H2,1-4H3/t20-,21+
InChIKey DRDZHMFYPWLHJH-OYRHEFFESA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3bAnKxsxPe
Name meso-3,5-Diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
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Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-16(26)32-20(9-5-18-7-11-22(28)24(13-18)30-3)15-21(33-17(2)27)10-6-19-8-12-23(29)25(14-19)31-4/h7-8,11-14,20-21,28-29H,5-6,9-10,15H2,1-4H3/t20-,21+
InChIKey DRDZHMFYPWLHJH-OYRHEFFESA-N
Molecular Weight 460.523 g/mol
SMILES Oc1c(cc(CC[C@](C[C@](CCc2cc(c(cc2)O)OC)(OC(=O)C)[H])(OC(=O)C)[H])cc1)OC
SPLASH splash10-000i-0900100000-c9685ecf52a527d3f739
Source of Spectrum E1-39-122-3
Synonyms (1R,3S)-3-(acetyloxy)-5-(4-hydroxy-3-methoxyphenyl)-1-[2-(4-hydroxy-3-methoxyphenyl)ethyl]pentyl acetate Acetic acid[(1R,3S)-3-acetoxy-1-homovanillyl-5-(4-hydroxy-3-methoxy-phenyl)pentyl]ester Acetic acid[(3R,5S)-5-acetyloxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-yl]ester [(1R,3S)-3-acetoxy-5-(4-hydroxy-3-methoxy-phenyl)-1-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]pentyl]acetate [(3R,5S)-5-acetyloxy-1,7-bis(3-methoxy-4-oxidanyl-phenyl)heptan-3-yl]ethanoate [(3R,5S)-5-acetyloxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-yl]acetate Acetic acid [(3R,5S)-5-acetyloxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-yl] ester [(3R,5S)-5-acetyloxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-yl] acetate [(1R,3S)-3-acetoxy-5-(4-hydroxy-3-methoxy-phenyl)-1-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]pentyl] acetate [(3R,5S)-5-acetyloxy-1,7-bis(3-methoxy-4-oxidanyl-phenyl)heptan-3-yl] ethanoate
Wiley ID 1518732