(11β,16α)-21-(3-Carboxy-1-oxopropoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
CAS Registry Number®
3092-61-3
CAS Name
(11β,16α)-21-(3-Carboxy-1-oxopropoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dioneMolecular Formula
C28H35FO9Molecular Mass
534.57Cite this Page
(11β,16α)-21-(3-Carboxy-1-oxopropoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3092-61-3 (retrieved ) (CAS RN: 3092-61-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H35FO9/c1-24(2)37-21-12-18-17-6-5-15-11-16(30)9-10-25(15,3)27(17,29)19(31)13-26(18,4)28(21,38-24)20(32)14-36-23(35)8-7-22(33)34/h9-11,17-19,21,31H,5-8,12-14H2,1-4H3,(H,33,34)/t17-,18-,19-,21+,25-,26-,27-,28+/m0/s1
InChIKey
InChIKey=GWKQSBXDFHODNU-UQPSFNCESA-N
SMILES
C(COC(CCC(O)=O)=O)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(C)(C)O2)[H])([C@]4([C@](F)([C@@H](O)C3)[C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H]
Canonical SMILES
O=C1C=CC2(C(=C1)CCC3C4CC5OC(OC5(C(=O)COC(=O)CCC(=O)O)C4(C)CC(O)C32F)(C)C)C
Other Names for this Substance
- Pregna-1,4-diene-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (11β,16α)-
- Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,16α,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetone, 21-(hydrogen succinate)
- Succinic acid, 21-monoester with 9-fluoro-11β,16α,17,21-tetrahydroxypregna-1,4-diene-3,20-dione cyclic 16,17-acetal with acetone
- 2H-Naphth[2′,1′:4,5]indeno[1,2-d][1,3]dioxole, pregna-1,4-diene-3,20-dione deriv.
- (11β,16α)-21-(3-Carboxy-1-oxopropoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
