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(Q82543762)
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Q82977142
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English
Sodium 1-methoxy-1-oxo-12-(sulfooxy)octadecan-9-yl sulfate
chemical compound
Sodium 18-methoxy-18-oxo-10-(sulfooxy)octadecan-7-yl sulfate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
512.1725836639998
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₃₇NaO₁₀S₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCCC(CCC(CCCCCCCC(=O)OC)OS(=O)(=O)O)OS(=O)(=O)[O-].[Na+]
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H38O10S2.Na/c1-3-4-5-9-12-17(28-30(21,22)23)15-16-18(29-31(24,25)26)13-10-7-6-8-11-14-19(20)27-2;/h17-18H,3-16H2,1-2H3,(H,21,22,23)(H,24,25,26);/q;+1/p-1
0 references
InChIKey
VJWJZMKNCNWWBT-UHFFFAOYSA-M
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CAS Registry Number
707-15-3
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68856-39-3
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DSSTox substance ID
DTXSID20635439
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DTXSID80988559
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DSSTOX compound identifier
DTXCID80586190
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DTXCID501415697
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NSC number
19566
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