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Product Code
CIL-ULM-8132-0.1MG
CAS Number
Product Format
Neat
Molecular Formula
C18 H21 O5 S . Na
Molecular Weight
372.41
Product Categories
Pharmaceutical, Veterinary Compound & Metabolite Reference Materials
Alternate CAS Number
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DismissAnalyte Name
Estrone Sodium Sulfate
CAS Number
438-67-5
Molecular Formula
C18 H21 O5 S . Na
Molecular Weight
372.41
Accurate Mass
372.1007
SMILES
[Na+].C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(=O)(=O)[O-])ccc34)[C@@H]1CCC2=O
InChI
InChI=1S/C18H22O5S.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,2,4,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t14-,15-,16+,18+;/m1./s1
IUPAC
sodium;[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate
Alternate CAS Number
Free acid: 481-97-0
Storage Temperature
Room Temperature
Shipping Temperature
Room Temperature
Country of Origin
UNITED STATES
Product Format
Neat
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