(Q27127071)

CHEBI:60092 (English)

6 October 2016

chemical formula

C₂₈H₅₁O₁₅S⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2C(C(C(C(O2)CO)O)O)OS(=O)(=O)[O-])CO)O)O

1 reference

CHEBI:60092 (English)

6 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)OS(=O)(=O)[O-])CO)O)O

1 reference

CHEBI:60092 (English)

InChI=1S/C28H52O15S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(31)41-25-23(34)21(32)18(16-29)39-27(25)42-28-26(43-44(36,37)38)24(35)22(33)19(17-30)40-28/h18-19,21-30,32-35H,2-17H2,1H3,(H,36,37,38)/p-1/t18-,19-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1

6 October 2016

Identifiers

InChI

1 reference

CHEBI:60092 (English)

AKFSXZFFUZRYPP-FJUFGMPQSA-M

6 October 2016

InChIKey

2 references

CHEBI:60092 (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-O-Sulfonato-alpha-D-glucopyranosyl 2-O-palmitoyl-alpha-D-glucopyranoside (English)

6 October 2016

1 reference

CHEBI:60092 (English)

6 October 2016

ChEBI ID

60092

mapping relation type

1 reference