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8-[(5-CARBOXY-2,9-EPOXY)-BENZYL]-2,5-DIHYDROXY-1,1,4A,7,8-PENTAMETHYL-1,2,3,4,4A,6,7,8,9,19,10A-DODECAHYDROPHENANTHRENE

Compound with spectra: 1 NMR, and 1 MS (GC)

8-[(5-CARBOXY-2,9-EPOXY)-BENZYL]-2,5-DIHYDROXY-1,1,4A,7,8-PENTAMETHYL-1,2,3,4,4A,6,7,8,9,19,10A-DODECAHYDROPHENANTHRENE
SpectraBase Compound ID 6igBTwyTWO1
InChI InChI=1S/C27H36O5/c1-14-10-17(28)22-23-19(12-20-25(2,3)21(29)8-9-26(20,22)4)32-18-7-6-15(24(30)31)11-16(18)13-27(14,23)5/h6-7,11,14,17,19-21,28-29H,8-10,12-13H2,1-5H3,(H,30,31)/t14-,17+,19-,20-,21-,26-,27-/m1/s1
InChIKey MJJYRBWVKARFOM-FORJUWHVSA-N
Mol Weight 440.6 g/mol
Molecular Formula C27H36O5
Exact Mass 440.256274 g/mol
Enantiomer InChIKey MJJYRBWVKARFOM-IJCXWTIPSA-N

View Spectrum of 8-[(5-CARBOXY-2,9-EPOXY)-BENZYL]-2,5-DIHYDROXY-1,1,4A,7,8-PENTAMETHYL-1,2,3,4,4A,6,7,8,9,19,10A-DODECAHYDROPHENANTHRENE

MS (GC) Spectrum
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Source of Spectrum G4-63-1285-1

View Spectrum of 8-[(5-CARBOXY-2,9-EPOXY)-BENZYL]-2,5-DIHYDROXY-1,1,4A,7,8-PENTAMETHYL-1,2,3,4,4A,6,7,8,9,19,10A-DODECAHYDROPHENANTHRENE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent MEOD
  • 8-[5'-(Hydroxycarbonyl)-2',9'-epoxybenzyl]-2,5-dihydroxy-1,1,4a,7,8-pentamethyl-(dodecahydro)-phenanthrene
Title Journal or Book Year
New Antibacterial Metabolites from the Cyanobacterium Nostoc commune (EAWAG 122b) Journal of Natural Products 2000
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