InChI: | InChI=1/C19H37NO3.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17(2)19(22)23;/h17H,3-16H2,1-2H3,(H,20,21)(H,22,23);/q;+1/p-1/t17-;/m0./s1 |
Specification: |
The cas register number of Sodium N-hexadecanoyl-L-alaninate is 67395-94-2. It also can be called as N-(1-Oxohexadecyl)-L-alanine monosodium salt and the Systematic name about this chemical is L-alanine, N-(1-oxohexadecyl)-, sodium salt (1:1).
People can use the following data to convert to the molecule structure.
1.SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](C)C(=O)[O-].[Na+]
2.InChI: InChI=1/C19H37NO3.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17(2)19(22)23;/h17H,3-16H2,1-2H3,(H,20,21)(H,22,23);/q;+1/p-1/t17-;/m0./s1
3.InChIKey: RACQAMODIYVRSM-NQZFEOCMBH
4.Std. InChI: InChI=1S/C19H37NO3.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17(2)19(22)23;/h17H,3-16H2,1-2H3,(H,20,21)(H,22,23);/q;+1/p-1/t17-;/m0./s1
Std. InChIKey:RACQAMODIYVRSM-LMOVPXPDSA-M
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