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Reference substance information

IUPAC name:
Protein hydrolyzates, wool, reaction products with 3-chloro-2-hydroxypropyl-stearyl-dimethylammonium chloride
Synonyms
Names:
Identifier:
common name
Steardimonium hydroxypropyl hydrolysed wool
Identifier:
other: Chemical name
Keratin hydrolyzates, 2-hydroxy-3-(stearyldimethylammonio)propyl derivatives, chlorides

Molecular and structural information

Molecular formula:
Molecular formula of major active constituents:
C28H57ClN2O5 (representative for C18 alkyl Quaternised glutamic acid)
C29H62Cl1N5O3 (representative for C18 alkyl Quaternised arginine)
C34H69Cl1N6O6 (representative for C18 alkyl Quaternised dipeptide (arginine/glutamic acid))
Molecular weight:
ca. 508.19 - ca. 693.42
SMILES notation:
SMILES of major active constituents:
[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(O)CNC(CCC(O)=O)C(O)=O (representative for C18 alkyl Quaternised glutamic acid)
[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(O)CNC(CCCNC(N)=N)C(O)=O (representative for C18 alkyl Quaternised arginine)
[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(O)CNC(CCCNC(N)=N)C(=O)NC(CCC(O)=O)C(O)=O (representative for C18 alkyl Quaternised dipeptide (arginine/glutamic acid))
InChl:
InChI of major active constituents:
InChI=1/C28H56N2O5.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30(2,3)24-25(31)23-29-26(28(34)35)20-21-27(32)33;/h25-26,29,31H,4-24H2,1-3H3,(H-,32,33,34,35);1H (representative for C18 alkyl Quaternised glutamic acid)
InChI=1/C29H61N5O3.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-34(2,3)25-26(35)24-33-27(28(36)37)21-20-22-32-29(30)31;/h26-27,33,35H,4-25H2,1-3H3,(H4-,30,31,32,36,37);1H (representative for C18 alkyl Quaternised arginine)
InChI=1/C34H68N6O6.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-40(2,3)27-28(41)26-38-29(21-20-24-37-34(35)36)32(44)39-30(33(45)46)22-23-31(42)43;/h28-30,38,41H,4-27H2,1-3H3,(H6-,35,36,37,39,42,43,44,45,46);1H (representative for C18 alkyl Quaternised dipeptide (arginine/glutamic acid))
Structural formula:
Chemical structure