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About This Item
Empirical Formula (Hill Notation):
C19H27NaO5S · 2H2O
CAS Number:
Molecular Weight:
426.50
UNSPSC Code:
12352200
PubChem Substance ID:
EC Number:
214-152-2
MDL number:
assay
98%
optical activity
[α]20/D +10.5°, c = 4 in methanol
drug control
regulated under CDSA - not available from Sigma-Aldrich Canada
mp
148-149 °C (dec.) (lit.)
SMILES string
O.O.[Na+].C[C@]12CC[C@H]3[C@@H](CC=C4C[C@H](CC[C@]34C)OS([O-])(=O)=O)[C@@H]1CCC2=O
InChI
1S/C19H28O5S.Na.2H2O/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18;;;/h3,13-16H,4-11H2,1-2H3,(H,21,22,23);;2*1H2/q;+1;;/p-1/t13-,14-,15-,16-,18-,19-;;;/m0.../s1
InChI key
NLNMKDUYGPNWAO-OXNWJOIVSA-M
Biochem/physiol Actions
Dehydroisoandrosterone 3-sulfate sodium salt dihydrate is a negative allosteric modulator of GABAA receptors.
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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