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Phloraspin
SpectraBase Compound ID GHTPHVEbY5E
InChI InChI=1S/C23H28O8/c1-5-7-14(24)18-16(26)10-17(31-4)12(22(18)29)9-13-20(27)11(3)21(28)19(23(13)30)15(25)8-6-2/h10,26-30H,5-9H2,1-4H3
InChIKey ZMGUIBLJRFUNEX-UHFFFAOYSA-N
Mol Weight 432.47 g/mol
Molecular Formula C23H28O8
Exact Mass 432.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6G5r4cpJYsd
Name Phloraspin
Alternate Name(s) 1-[2,6-dihydroxy-4-methoxy-3-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]phenyl]-1-butanone 1-[3-(3-butyryl-2,4,6-trihydroxy-5-methyl-benzyl)-2,6-dihydroxy-4-methoxy-phenyl]butan-1-one 1-[3-[(3-butanoyl-2,4,6-trihydroxy-5-methyl-phenyl)methyl]-2,6-dihydroxy-4-methoxy-phenyl]butan-1-one 1-[3-[[3-butanoyl-5-methyl-2,4,6-tris(oxidanyl)phenyl]methyl]-4-methoxy-2,6-bis(oxidanyl)phenyl]butan-1-one
CAS Registry Number 1763-14-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O8
InChI InChI=1S/C23H28O8/c1-5-7-14(24)18-16(26)10-17(31-4)12(22(18)29)9-13-20(27)11(3)21(28)19(23(13)30)15(25)8-6-2/h10,26-30H,5-9H2,1-4H3
InChIKey ZMGUIBLJRFUNEX-UHFFFAOYSA-N
Molecular Weight 432.469 g/mol
SMILES Oc1c(c(c(c(c1Cc1c(cc(c(c1O)C(CCC)=O)O)OC)O)C)O)C(CCC)=O
SPLASH splash10-014i-9850000000-b5c5e0b24280917c2933
Source of Spectrum CD-574-0-0
Wiley ID 1382229