Equilin 3-Sulfate Sodium Salt

cas: 16680-47-0 — see every product listed under this CAS number, including other names

Equilin 3-Sulfate Sodium Salt (CAS 16680-47-0) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULE305
cas16680-47-0
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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Structural formula: {0} (CAS {1})

Equilin sodium sulfate is a steroid sulfate. It is functionally related to an equilin.

Source: ChEBI

Identity
Molecular formulaC18H19NaO5S
Molecular weight370.4 g/mol
IUPAC namesodium [(9S,13S,14S)-13-methyl-17-oxo-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate
InChIKeyQTTMOCOWZLSYSV-QWAPEVOJSA-M
SMILESC[C@]12CC[C@H]3C(=CCC4=C3C=CC(=C4)OS(=O)(=O)[O-])[C@@H]1CCC2=O.[Na+]

Computed by PubChem (NCBI)

Synonyms: Cenestin, Estrogens, conjugated synthetic A, Estrogens,conjugated synthetic a, Synthetic Conjugated Estrogens, A, SYNTHETIC CONJUGATED ESTROGENS A, Sodium equilin sulfate, Equilin sodium sulfate, Sodium equilin 3-monosulfate, Equilin 3-Sulfate Sodium Salt, Estratab
Related forms of this compound
sodium [(9S,13S,14S)-2,4,16,16-tetradeuterio-13-methyl-17-oxo-6,9,11,12,14,15-hexahydrocyclopenta[a]phenanthren-3-yl] sulfate C18H19NaO5S
Isomers (same molecular formula)
sodium [(13S,14S,17R)-17-hydroxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-3-yl] sulfate C18H19NaO5S
sodium [(13S,14S,17S)-17-hydroxy-13-methyl-11,12,14,15,16,17-hexahydrocyclopenta[a]phenanthren-3-yl] sulfate C18H19NaO5S
sodium [(13S,14S)-13-methyl-17-oxo-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate C18H19NaO5S
sodium [(17S)-4,16,16-trideuterio-17-hydroxy-13-methyl-12,14,15,17-tetrahydro-11H-cyclopenta[a]phenanthren-3-yl] sulfate C18H19NaO5S

Also listed as

Equilin 3-Sulfate Sodium Salt (Stabilized with TRIS, 50% w/w), >95% (HPLC) TRC CAS 16680-47-0