Cloprednol
CAS Registry Number®
5251-34-3
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CAS Name
CloprednolMolecular Formula
C21H25ClO5Molecular Mass
392.87Cite this Page
Cloprednol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5251-34-3 (retrieved ) (CAS RN: 5251-34-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H25ClO5/c1-19-5-3-11(24)7-14(19)15(22)8-12-13-4-6-21(27,17(26)10-23)20(13,2)9-16(25)18(12)19/h3,5,7-8,12-13,16,18,23,25,27H,4,6,9-10H2,1-2H3/t12-,13-,16-,18+,19-,20-,21-/m0/s1
InChIKey
InChIKey=YTJIBEDMAQUYSZ-FDNPDPBUSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(C(Cl)=C3)=CC(=O)C=C4)([C@@H](O)C1)[H])[H])(CC[C@@]2(C(CO)=O)O)[H]
Canonical SMILES
O=C1C=CC2(C(=C1)C(Cl)=CC3C4CCC(O)(C(=O)CO)C4(C)CC(O)C32)C
Other Names for this Substance
- Pregna-1,4,6-triene-3,20-dione, 6-chloro-11,17,21-trihydroxy-, (11β)-
- Pregna-1,4,6-triene-3,20-dione, 6-chloro-11β,17,21-trihydroxy-
- (11β)-6-Chloro-11,17,21-trihydroxypregna-1,4,6-triene-3,20-dione
- Cloprednol
- Synestan
