Products 13209-45-5

CAS 13209-45-5 is the registry number for 4,6-Estradien-3,17-dione. Offered by: TRC. Available pack sizes: 1g.

4,6-Estradien-3,17-dione
TRC
  • size: 1g
  • Variants: 1
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Structural formula: {0} (CAS {1})

(8R,9S,10R,13S,14S)-13-methyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione (CAS 13209-45-5) is a chemical compound with the molecular formula C18H22O2 and a molecular weight of 270.4 g/mol. IUPAC name: (8R,9S,10R,13S,14S)-13-methyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione. InChIKey: GKSFRYHLOMZMFQ-QXUSFIETSA-N.

Identity
Molecular formulaC18H22O2
Molecular weight270.4 g/mol
IUPAC name(8R,9S,10R,13S,14S)-13-methyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione
InChIKeyGKSFRYHLOMZMFQ-QXUSFIETSA-N
SMILESC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C=C[C@H]3[C@@H]1CCC2=O

Computed by PubChem (NCBI)

Synonyms: 4,6-Estradiene-3,17-dione, Estra-4,6-diene-3,17-dione, 4,6-estradien-3,17-dione, GKSFRYHLOMZMFQ-QXUSFIETSA-N, (8R,9S,10R,13S,14S)-13-methyl-1,2,8,9,10,11,12,14,15,16-deca
Isomers (same molecular formula)
(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one C18H22O2
naphthalen-2-yl octanoate C18H22O2
4-(4-hydroxy-2,3,5-trimethylphenyl)-2,3,6-trimethylphenol C18H22O2
3-(4-methylphenyl)adamantane-1-carboxylic acid C18H22O2
3-(1-adamantyl)-2-hydroxy-5-methylbenzaldehyde C18H22O2
[4-(1-adamantyl)phenyl] acetate C18H22O2
(5-tert-butyl-2-phenylmethoxyphenyl)methanol C18H22O2
4-[(3S,4R)-4-(4-hydroxyphenyl)hexan-3-yl]phenol C18H22O2
(8S,13S,14S,17S)-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol C18H22O2
(9S,13S,14S,17S)-13-methyl-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene-3,17-diol C18H22O2
2-[2-(4-propan-2-ylphenyl)propan-2-yl]benzene-1,4-diol C18H22O2
4-[2,2,3,4,5,5-hexadeuterio-4-(4-hydroxyphenyl)hexan-3-yl]phenol C18H22O2