Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-21-hydroxy-16-methyl-, (9β,11β,16α)-
CAS Registry Number®
61339-43-3
No image available.
CAS Name
Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-21-hydroxy-16-methyl-, (9β,11β,16α)-Molecular Formula
C22H27BrO4Molecular Mass
435.35Cite this Page
Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-21-hydroxy-16-methyl-, (9β,11β,16α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=61339-43-3 (retrieved ) (CAS RN: 61339-43-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H27BrO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)22(15)18(27-22)10-20(16,3)21(12,23)17(26)11-24/h6-7,9,12,15-16,18,24H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,18+,19+,20+,21+,22-/m1/s1
InChIKey
InChIKey=HEKUKYICGJFGFQ-QDBZYVRYSA-N
SMILES
C[C@@]12[C@@]34[C@]([C@]5([C@](C)(C[C@@]3(O4)[H])[C@](C(CO)=O)(Br)[C@H](C)C5)[H])(CCC1=CC(=O)C=C2)[H]
Canonical SMILES
O=C1C=CC2(C(=C1)CCC3C4CC(C)C(Br)(C(=O)CO)C4(C)CC5OC532)C
Other Names for this Substance
- Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-21-hydroxy-16-methyl-, (9β,11β,16α)-
- 9,11-Epoxy-9H-cyclopenta[a]phenanthrene, pregna-1,4-diene-3,20-dione deriv.
