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METHYL-[1R-(1-ALPHA,4A-BETA,7-BETA,8-BETA,10A-ALPHA)]-1,2,3,4A,5,6,7,8,9,10A-DODECAHYDRO-7,8-DIHYDROXY-1,4A-DIMETHYL-7-(1-METHYLETHYL)-PHENANTHREN
SpectraBase Compound ID KlgJ5hHpKyC
InChI InChI=1S/C21H34O4/c1-13(2)21(24)12-9-15-14(17(21)22)7-8-16-19(15,3)10-6-11-20(16,4)18(23)25-5/h13,16-17,22,24H,6-12H2,1-5H3/t16-,17+,19-,20-,21+/m1/s1
InChIKey KGBHADWQRUIUEF-ZVXZJYCBSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol
Enantiomer InChIKey KGBHADWQRUIUEF-YZUZWNONSA-N
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AH-126-1113-5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • (1R,4aS,7S,8S,10aR)-7,8-dihydroxy-1,4a-dimethyl-7-propan-2-yl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
  • Methyl (1R,4aS,7S,8S,10aR)-7,8-dihydroxy-1,4a-dimethyl-7-propan-2-yl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
  • Methyl (1R,4aS,7S,8S,10aR)-7,8-dihydroxy-7-isopropyl-1,4a-dimethyl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
  • Methyl (1R,4aS,7S,8S,10aR)-1,4a-dimethyl-7,8-bis(oxidanyl)-7-propan-2-yl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
  • (1R,4aS,7S,8S,10aR)-7,8-dihydroxy-7-isopropyl-1,4a-dimethyl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
Title Journal or Book Year
New chiral synthons from abietic acid: Oxidation of the C-ring and degradation of the carbon skeleton Monatshefte f�r Chemie Chemical Monthly 1995
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