methyl glucose isostearate (Q27258264)

Methyl 6-O-(16-methylheptadecanoyl)-D-glucopyranoside (English)

14 October 2016

chemical formula

C₂₅H₄₈O₇

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C)CCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OC)O)O)O

1 reference

methyl glucose isostearate (English)

14 October 2016

isomeric SMILES

CC(C)CCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OC)O)O)O

1 reference

methyl glucose isostearate (English)

InChI=1S/C25H48O7/c1-19(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-21(26)31-18-20-22(27)23(28)24(29)25(30-3)32-20/h19-20,22-25,27-29H,4-18H2,1-3H3/t20-,22-,23+,24-,25?/m1/s1

14 October 2016

Identifiers

InChI

1 reference

methyl glucose isostearate (English)

FQDOYQZLFOUVLE-JUIXOQOVSA-N

14 October 2016

InChIKey

1 reference

methyl glucose isostearate (English)

14 October 2016

1 reference

methyl glucose isostearate (English)

14 October 2016

1 reference

matched by identifier from

Methyl 6-O-(16-methylheptadecanoyl)-D-glucopyranoside (English)

14 October 2016

2 references

26 December 2021

InChIKey

FQDOYQZLFOUVLE-JUIXOQOVSA-N

1 reference

2 references

methyl glucose isostearate (English)