stearyldimoniumhydroxypropyl butylglucoside chloride (Q27237270)

Butyl 6-O-{3-[dimethyl(octadecyl)ammonio]-2-hydroxypropyl}-beta-D-glucopyranoside chloride (English)

13 October 2016

chemical formula

C₃₃H₆₈ClNO₇

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(COCC1C(C(C(C(O1)OCCCC)O)O)O)O.[Cl-]

1 reference

stearyldimoniumhydroxypropyl butylglucoside chloride (English)

13 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(COC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OCCCC)O)O)O)O.[Cl-]

1 reference

stearyldimoniumhydroxypropyl butylglucoside chloride (English)

InChI=1S/C33H68NO7.ClH/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-34(3,4)25-28(35)26-39-27-29-30(36)31(37)32(38)33(41-29)40-24-8-6-2;/h28-33,35-38H,5-27H2,1-4H3;1H/q+1;/p-1/t28?,29-,30-,31+,32-,33-;/m1./s1

13 October 2016

Identifiers

InChI

1 reference

stearyldimoniumhydroxypropyl butylglucoside chloride (English)

YMMBUQIZJFLYNT-GSBPSSQPSA-M

13 October 2016

InChIKey

1 reference

stearyldimoniumhydroxypropyl butylglucoside chloride (English)

13 October 2016

1 reference

matched by identifier from

Butyl 6-O-{3-[dimethyl(octadecyl)ammonio]-2-hydroxypropyl}-beta-D-glucopyranoside chloride (English)

13 October 2016

2 references

26 December 2021

InChIKey

YMMBUQIZJFLYNT-GSBPSSQPSA-M

1 reference

2 references

stearyldimoniumhydroxypropyl butylglucoside chloride (English)