Equilin 3-Sulfate Sodium Salt

Product Name Equilin 3-Sulfate Sodium Salt
Alternate Names Equilin Metabolites, Metabolites of Equilin
CAT No. CS-T-21890
CAS No. 16680-47-0
Category Metabolites
Stock IN-Stock
Mol. Wt. 370.40 g/mol
Mol. For. C₁₈H₁₉NaO₅S
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Equilin
Purity 95%
Smileys C[C@@]1(C2=O)[C@](CC2)([H])C3=CCC4=C(C=CC(O[S](=O)([O-])=O)=C4)[C@@]3([H])CC1.[Na+]
Canonical Smiles CC12CCC3C(=CCC4=C3C=CC(=C4)OS(=O)(=O)[O-])C1CCC2=O.[Na+]
InchIKey QTTMOCOWZLSYSV-QWAPEVOJSA-M
Inchl InChI=1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3-5,10,14,16H,2,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t14-,16+,18+;/m1./s1
IUPAC sodium;[(9S,13S,14S)-13-methyl-17-oxo-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate
Controlled No
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