17α-Dihydro equilin 3-sulfate

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Catalog Number
ACM56050056
Product Name
17α-Dihydro equilin 3-sulfate
Structure
Structure
CAS
56050-05-6
Category
Heterocyclic Organic Compound
Synonyms
(17α)-Estra-1,3,5(10),7-tetraene-3,17-diol 3-(Hydrogen Sulfate) Sodium Salt; 17α-Dihydroequilin Sodium Sulfate; α-Equilol Sodium Sulfate;
IUPAC Name
sodium (13S,17R)-13-methyl-3-sulfooxy-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-olate
Molecular Weight
372.41
Molecular Formula
C18H21NaO5S
Canonical SMILES
CC12CCC3C(=CCC4=C3C=CC(=C4)OS(=O)(=O)[O-])C1CCC2O.[Na+]
InChI Key
RTFCFYWYGHLFIY-WETCULGCSA-N
EC Number
259-967-4
Exact Mass
372.10100
H-Bond Acceptor
5
H-Bond Donor
1
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