Products 122605-91-8

CAS 122605-91-8 appears in our catalog under these names: (5Alpha)-Estrane-3,17-dione-d6, (5a)-Estrane-3,17-dione-d6. Offered by: TRC. Available pack sizes: 10mg, 25mg, 5mg.

(5Alpha)-Estrane-3,17-dione-d6
TRC
  • size: 10mg, 5mg
  • Variants: 2
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(5a)-Estrane-3,17-dione-d6
TRC
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

(5S,8R,9R,10S,13S,14S)-2,2,4,4,16,16-hexadeuterio-13-methyl-5,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione (CAS 122605-91-8) is a chemical compound with the molecular formula C18H26O2 and a molecular weight of 280.4 g/mol. IUPAC name: (5S,8R,9R,10S,13S,14S)-2,2,4,4,16,16-hexadeuterio-13-methyl-5,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione. InChIKey: CRDKSBHJIGNEOH-HZGHLBCRSA-N.

Identity
Molecular formulaC18H26O2
Molecular weight280.4 g/mol
IUPAC name(5S,8R,9R,10S,13S,14S)-2,2,4,4,16,16-hexadeuterio-13-methyl-5,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
InChIKeyCRDKSBHJIGNEOH-HZGHLBCRSA-N
SMILES[2H]C1(C[C@H]2[C@@H]3CC[C@@H]4[C@@H]([C@H]3CC[C@@]2(C1=O)C)CC(C(=O)C4([2H])[2H])([2H])[2H])[2H]

Computed by PubChem (NCBI)

Synonyms: (5a)-Estrane-3,17-dione-d6, (5Alpha)-Estrane-3,17-dione-d6
Related forms of this compound
(5S,8R,9R,10S,13S,14S)-13-methyl-1,2,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-dione C18H26O2
(5R,8R,9R,10S,13S,14S)-13-methyl-1,2,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-dione C18H26O2
Isomers (same molecular formula)
4-methylhept-4-en-1-yn-3-yl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate C18H26O2
4-(4-pentylcyclohexyl)benzoic acid C18H26O2
(8R,9S,10R,13S,14S,17R)-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one C18H26O2
(8R,9S,10R,13S,14S,17S)-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one C18H26O2
(8R,9S,10R,13S,14S,17S)-16,16,17-trideuterio-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-one C18H26O2
(3S,8R,9S,10R,13S,14S)-3-hydroxy-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one C18H26O2
(3R,8R,9S,10R,13S,14S)-3-hydroxy-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one C18H26O2
4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromen-1-ol C18H26O2
(3S,5S,8R,9S,10R,13S,14S)-3-hydroxy-13-methyl-4,5,6,7,8,9,10,11,12,14,15,16-dodecahydro-3H-cyclopenta[a]phenanthren-17-one C18H26O2
(1S,2R,4R)-1-methyl-2-[(2-methylphenyl)methoxy]-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane C18H26O2