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21-BIS-(1,1-DIMETHYL-2-PYRROLYL)-17-HYDROXY-3,11,20-TRIOXOPREGN-4-ENE

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21-BIS-(1,1-DIMETHYL-2-PYRROLYL)-17-HYDROXY-3,11,20-TRIOXOPREGN-4-ENE
SpectraBase Compound ID 2GVoC402wA4
InChI InChI=1S/C31H38N2O4/c1-29-13-11-20(34)17-19(29)9-10-21-22-12-14-31(37,30(22,2)18-25(35)27(21)29)28(36)26(23-7-5-15-32(23)3)24-8-6-16-33(24)4/h5-8,15-17,21-22,26-27,37H,9-14,18H2,1-4H3/t21-,22-,27+,29-,30-,31?/m0/s1
InChIKey KIBWXFCNOWWPON-YGYYYPQZSA-N
Mol Weight 502.7 g/mol
Molecular Formula C31H38N2O4
Exact Mass 502.283158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GWOUx2WpBly
Name 21-BIS-(1,1-DIMETHYL-2-PYRROLYL)-17-HYDROXY-3,11,20-TRIOXOPREGN-4-ENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38N2O4
InChI InChI=1S/C31H38N2O4/c1-29-13-11-20(34)17-19(29)9-10-21-22-12-14-31(37,30(22,2)18-25(35)27(21)29)28(36)26(23-7-5-15-32(23)3)24-8-6-16-33(24)4/h5-8,15-17,21-22,26-27,37H,9-14,18H2,1-4H3/t21-,22-,27+,29-,30-,31?/m0/s1
InChIKey KIBWXFCNOWWPON-YGYYYPQZSA-N
Literature Reference Author H.TOKUNAGA,M.TANNO,T.KIMURA
Literature Reference Citation CHEM.PHARM.BULL.,35,1118(1987)
Literature Reference DOI 10.1248/cpb.35.1118
Molecular Weight 502.654 g/mol
Solvent CDCl3
Source File Reference UWBK1142