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2'-O-Methylhyperlatolic Acid

View entire compound with spectra: 1 MS (GC)

2'-O-Methylhyperlatolic Acid
SpectraBase Compound ID 2xQRWgUNwNH
InChI InChI=1S/C28H38O7/c1-5-7-9-10-12-14-20-16-22(18-24(34-4)26(20)27(30)31)35-28(32)25-19(13-11-8-6-2)15-21(33-3)17-23(25)29/h15-18,29H,5-14H2,1-4H3,(H,30,31)
InChIKey GZGUIQHCYLUWPM-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C28H38O7
Exact Mass 486.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 457WmXq8jPk
Name 2'-O-Methylhyperlatolic Acid
Alternate Name(s) 2-Heptyl-4-(2'-hydroxy-4'-methoxy-6'-pentylbenzoyloxy)-6-methoxybenzoic acid 2-Heptyl-4-[(2-hydroxy-4-methoxy-6-pentylbenzoyl)oxy]-6-methoxybenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O7
InChI InChI=1S/C28H38O7/c1-5-7-9-10-12-14-20-16-22(18-24(34-4)26(20)27(30)31)35-28(32)25-19(13-11-8-6-2)15-21(33-3)17-23(25)29/h15-18,29H,5-14H2,1-4H3,(H,30,31)
InChIKey GZGUIQHCYLUWPM-UHFFFAOYSA-N
Molecular Weight 486.605 g/mol
SMILES OC(c1c(cc(OC(c2c(cc(cc2CCCCC)OC)O)=O)cc1CCCCCCC)OC)=O
SPLASH splash10-001r-0900000000-ec9e5414b7aedf60ea80
Source of Spectrum B-44-1646-3
Wiley ID 1396516