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TETRAHYDRO-11-DEOXYCORTISOL-3,21-DISULFATE;17-ALPHA-HYDROXY-3-ALPHA,21-DISULFOOXY-5-BETA-PREGNAN-20-ONE-DISODIUM-SALT
SpectraBase Compound ID C4R3gqjxuzp
InChI InChI=1S/C21H34O10S2.2Na/c1-19-8-5-14(31-33(27,28)29)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,23)18(22)12-30-32(24,25)26;;/h13-17,23H,3-12H2,1-2H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/t13-,14-,15-,16+,17+,19+,20+,21+;;/m1../s1
InChIKey VKBOJMOLZPDIAW-KQBTYVKTSA-L
Mol Weight 554.57653856 g/mol
Molecular Formula C21H32Na2O10S2
Exact Mass 554.123228 g/mol
Parent InChIKey TYGLEENAVLJOMS-FAIYVORSSA-L
Enantiomer InChIKey VKBOJMOLZPDIAW-KNOGOUQBSA-L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Title Journal or Book Year
Potential Corticoid Metabolites: Chemical Synthesis of 3- and 21-Monosulfates and Their Double-Conjugates of Tetrahydrocorticosteroids in the 5.ALPHA.- and 5.BETA.-Series Chemical and Pharmaceutical Bulletin 2010

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