Products 114896-41-2

CAS 114896-41-2 is the registry number for Estra-5(10),9(11)-diene-3,17-dione, 16-bromo-, cyclic 3-(1,2-ethanediyl acetal), (16α)- (9CI). Offered by: Chemat. Available pack sizes: 1g.

Estra-5(10),9(11)-diene-3,17-dione, 16-bromo-, cyclic 3-(1,2-ethanediyl acetal), (16α)- (9CI)
Chemat
  • size: 1g
  • Variants: 1
from 19490.00
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Structural formula: {0} (CAS {1})

(8S,13S,14S,16R)-16-bromo-13-methylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-one (CAS 114896-41-2) is a chemical compound with the molecular formula C20H25BrO3 and a molecular weight of 393.3 g/mol. IUPAC name: (8S,13S,14S,16R)-16-bromo-13-methylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-one. InChIKey: ZKASTKBAIFGZDU-NTDBWNAOSA-N.

Identity
Molecular formulaC20H25BrO3
Molecular weight393.3 g/mol
IUPAC name(8S,13S,14S,16R)-16-bromo-13-methylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-one
InChIKeyZKASTKBAIFGZDU-NTDBWNAOSA-N
SMILESC[C@]12CC=C3[C@H]([C@@H]1C[C@H](C2=O)Br)CCC4=C3CCC5(C4)OCCO5

Computed by PubChem (NCBI)

Synonyms: 16-Bromo-3,3-ethylenedioxy-5(10),9(11)-estradien-17-one