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12-BETA-HYDROXYMEXRENONE;12-BETA,17-DIHYDROXY-3-OXO-17-ALPHA-PREGN-4-ENE-7-ALPHA,21-DICARBOXYLIC-ACID-7-METHYLESTER-GAMMA-LACTONE

View entire compound with spectra: 1 NMR

12-BETA-HYDROXYMEXRENONE;12-BETA,17-DIHYDROXY-3-OXO-17-ALPHA-PREGN-4-ENE-7-ALPHA,21-DICARBOXYLIC-ACID-7-METHYLESTER-GAMMA-LACTONE
SpectraBase Compound ID I0heksyWRHe
InChI InChI=1S/C24H32O6/c1-22-7-4-14(25)10-13(22)11-15(21(28)29-3)20-16-5-8-24(9-6-19(27)30-24)23(16,2)18(26)12-17(20)22/h10,15-18,20,26H,4-9,11-12H2,1-3H3/t15-,16+,17+,18-,20+,22+,23-,24?/m1/s1
InChIKey UVSJTCSYPPQVQW-PVGICKLZSA-N
Mol Weight 416.5 g/mol
Molecular Formula C24H32O6
Exact Mass 416.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FaIqXtA4moW
Name 12-BETA-HYDROXYMEXRENONE;12-BETA,17-DIHYDROXY-3-OXO-17-ALPHA-PREGN-4-ENE-7-ALPHA,21-DICARBOXYLIC-ACID-7-METHYLESTER-GAMMA-LACTONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O6
InChI InChI=1S/C24H32O6/c1-22-7-4-14(25)10-13(22)11-15(21(28)29-3)20-16-5-8-24(9-6-19(27)30-24)23(16,2)18(26)12-17(20)22/h10,15-18,20,26H,4-9,11-12H2,1-3H3/t15-,16+,17+,18-,20+,22+,23-,24?/m1/s1
InChIKey UVSJTCSYPPQVQW-PVGICKLZSA-N
Literature Reference Author C.L.PREISIG,J.A.LAAKSO,E.M.MOCEK,P.T.WANG,J.BAEZ,G.BYNG
Literature Reference Citation J.NAT.PROD.,66,350(2003)
Literature Reference DOI 10.1021/np020347a
Molecular Weight 416.514 g/mol
Solvent CDCl3
Source File Reference UWSI4606