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Reference substances

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IUPAC name:
disodium (Z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate

Inventory

EC number:
261-222-3
EC name:
Disodium (Z)-4-(9-octadecenylamino)-4-oxo-2(or 3)-sulphonatobutyrate
CAS number:
58353-68-7
CAS number:
58353-68-7
Synonyms
Names:
Identifier:
IUPAC name
Disodium 4-[(9Z)-9-octadecen-1-ylamino]-4-oxo-2-sulfonatobutanoate

Molecular and structural information

Molecular formula:
C22H41NO6S.2Na
Molecular weight:
491.593
SMILES notation:
CCCCCCCC/C=C\CCCCCCCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]
InChl:
InChI=1S/C22H41NO6S.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-21(24)19-20(22(25)26)30(27,28)29;;/h9-10,20H,2-8,11-19H2,1H3,(H,23,24)(H,25,26)(H,27,28,29);;/q;2*+1/p-2/b10-9-;;
Structural formula:
Chemical structure

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