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(1R,4aR,4bS,7R,8S,8aR,10aR)-8-hydroxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid

View entire compound with spectra: 1 NMR

(1R,4aR,4bS,7R,8S,8aR,10aR)-8-hydroxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid
SpectraBase Compound ID DdWjbr47q0F
InChI InChI=1S/C23H36O6/c1-20(12-23(28)11-17(24)29-13-23)10-7-15-14(18(20)25)5-6-16-21(15,2)8-4-9-22(16,3)19(26)27/h14-16,18,25,28H,4-13H2,1-3H3,(H,26,27)/t14-,15+,16-,18+,20-,21-,22-,23?/m1/s1
InChIKey DMTVRZAYXIRVBH-YYFJRWGPSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H36O6
Exact Mass 408.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2zwk6VSeh3i
Name (1R,4aR,4bS,7R,8S,8aR,10aR)-8-hydroxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O6
InChI InChI=1S/C23H36O6/c1-20(12-23(28)11-17(24)29-13-23)10-7-15-14(18(20)25)5-6-16-21(15,2)8-4-9-22(16,3)19(26)27/h14-16,18,25,28H,4-13H2,1-3H3,(H,26,27)/t14-,15+,16-,18+,20-,21-,22-,23?/m1/s1
InChIKey DMTVRZAYXIRVBH-YYFJRWGPSA-N
Literature Reference Author A.SANFELICIANO,M.MEDARDE,F.TOME,B.HEBRERO,E.CABALLERO
Literature Reference Citation MAGN.RES.CHEM.,27,1166(1989)
Literature Reference DOI 10.1002/mrc.1260271211
Molecular Weight 408.535 g/mol
Solvent C5D5N
Source File Reference UWCS16180