(11β)-14,17-[2-Butenylidenebis(oxy)]-11-hydroxy-21-[(4-pyridinylcarbonyl)oxy]pregn-4-ene-3,20-dione
CAS Registry Number®
65415-41-0
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CAS Name
(11β)-14,17-[2-Butenylidenebis(oxy)]-11-hydroxy-21-[(4-pyridinylcarbonyl)oxy]pregn-4-ene-3,20-dioneMolecular Formula
C31H37NO7Molecular Mass
535.63Cite this Page
(11β)-14,17-[2-Butenylidenebis(oxy)]-11-hydroxy-21-[(4-pyridinylcarbonyl)oxy]pregn-4-ene-3,20-dione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=65415-41-0 (retrieved ) (CAS RN: 65415-41-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C31H37NO7/c1-4-5-25-38-30-12-13-31(39-25,24(35)18-37-27(36)19-9-14-32-15-10-19)29(30,3)17-23(34)26-22(30)7-6-20-16-21(33)8-11-28(20,26)2/h4-5,9-10,14-16,22-23,25-26,34H,6-8,11-13,17-18H2,1-3H3/t22-,23+,25?,26-,28+,29+,30-,31+/m1/s1
InChIKey
InChIKey=LZHLAFIPUJPCBN-MOPCRLEQSA-N
SMILES
C[C@@]12[C@]3([C@]4([C@]([C@@H](O)C1)([C@]5(C)C(CC4)=CC(=O)CC5)[H])[H])CC[C@@]2(C(COC(=O)C=6C=CN=CC6)=O)OC(C=CC)O3
Canonical SMILES
O=C(OCC(=O)C12OC(OC3(CC1)C4CCC5=CC(=O)CCC5(C)C4C(O)CC23C)C=CC)C=6C=CN=CC6
Other Names for this Substance
- Pregn-4-ene-3,20-dione, 14,17-[2-butenylidenebis(oxy)]-11-hydroxy-21-[(4-pyridinylcarbonyl)oxy]-, (11β)-
- (11β)-14,17-[2-Butenylidenebis(oxy)]-11-hydroxy-21-[(4-pyridinylcarbonyl)oxy]pregn-4-ene-3,20-dione
- Nicocortonide
