sucrose 1,6-distearate (Q27271923)

UNII-96QS1D0T15 (English)

14 October 2016

chemical formula

C₄₈H₉₀O₁₃

1 reference

UNII-96QS1D0T15 (English)

14 October 2016

canonical SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)COC(=O)CCCCCCCCCCCCCCCCC)O)O)O

1 reference

UNII-96QS1D0T15 (English)

14 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)COC(=O)CCCCCCCCCCCCCCCCC)O)O)O

1 reference

UNII-96QS1D0T15 (English)

InChI=1S/C48H90O13/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(50)57-36-39-42(52)44(54)45(55)47(59-39)61-48(46(56)43(53)38(35-49)60-48)37-58-41(51)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39,42-47,49,52-56H,3-37H2,1-2H3/t38-,39-,42-,43-,44+,45-,46+,47-,48+/m1/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-96QS1D0T15 (English)

FOLJTMYCYXSPFQ-CJKAUBRRSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-96QS1D0T15 (English)

14 October 2016

1 reference

UNII

96QS1D0T15

sucrose 1,6-distearate (English)

14 October 2016

1 reference

1-O-Stearoyl-beta-D-fructofuranosyl 6-O-stearoyl-alpha-D-glucopyranoside (English)

14 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

UNII-96QS1D0T15 (English)

14 October 2016

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

96QS1D0T15

sucrose 1,6-distearate (English)