(Q27130584)

CHEBI:61041 (English)

7 October 2016

chemical formula

C₁₄H₂₄NO₁₄S⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(=O)NC1C(C(C(OC1O)CO)O)OC2C(C(C(C(O2)COS(=O)(=O)[O-])O)O)O

1 reference

CHEBI:61041 (English)

7 October 2016

isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COS(=O)(=O)[O-])O)O)O

1 reference

CHEBI:61041 (English)

InChI=1S/C14H25NO14S/c1-4(17)15-7-12(9(19)5(2-16)27-13(7)22)29-14-11(21)10(20)8(18)6(28-14)3-26-30(23,24)25/h5-14,16,18-22H,2-3H2,1H3,(H,15,17)(H,23,24,25)/p-1/t5-,6-,7-,8-,9+,10+,11-,12-,13-,14+/m1/s1

7 October 2016

Identifiers

InChI

1 reference

CHEBI:61041 (English)

ZSSIKYJYLIRCAK-UHDFQWBXSA-M

7 October 2016

InChIKey

2 references

CHEBI:61041 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-Acetamido-2-deoxy-3-O-(6-O-sulfonato-beta-D-glucopyranosyl)-beta-D-galactopyranose (English)

7 October 2016

1 reference

CHEBI:61041 (English)

7 October 2016

ChEBI ID

61041

mapping relation type

1 reference