(Q27133725)

[3OSO3]Galbeta1-4Glcbeta (English)

19 October 2016

stereoisomer of

D-Galp3S-(1->4)-D-Glcp

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₂H₂₂O₁₄S

1 reference

[3OSO3]Galbeta1-4Glcbeta (English)

19 October 2016

canonical SMILES

C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)OS(=O)(=O)O)O)O

1 reference

[3OSO3]Galbeta1-4Glcbeta (English)

19 October 2016

isomeric SMILES

C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)OS(=O)(=O)O)O)O

1 reference

[3OSO3]Galbeta1-4Glcbeta (English)

InChI=1S/C12H22O14S/c13-1-3-5(15)10(26-27(20,21)22)8(18)12(24-3)25-9-4(2-14)23-11(19)7(17)6(9)16/h3-19H,1-2H2,(H,20,21,22)/t3-,4-,5+,6-,7-,8-,9-,10+,11-,12+/m1/s1

19 October 2016

Identifiers

InChI

1 reference

[3OSO3]Galbeta1-4Glcbeta (English)

ZMPFTLRVVIHHOO-QFKDBGNMSA-N

19 October 2016

InChIKey

2 references

[3OSO3]Galbeta1-4Glcbeta (English)

19 October 2016

stated in

ChEBI release 2020-09-01

1 reference

4-O-(3-O-Sulfo-beta-D-galactopyranosyl)-beta-D-glucopyranose (English)

19 October 2016

2 references

[3OSO3]Galbeta1-4Glcbeta (English)

matched by identifier from

19 October 2016

InChIKey

ZMPFTLRVVIHHOO-QFKDBGNMSA-N

Reaxys registry number

8365153

1 reference

beta-D-Galp3S-(1->4)-beta-D-Glcp (English)

19 October 2016

ChEBI ID

65179

mapping relation type

2 references

beta-D-Galp3S-(1->4)-beta-D-Glcp (English)

matched by identifier from

19 October 2016

International Chemical Identifier

InChI

InChI=1S/C12H22O14S/c13-1-3-5(15)10(26-27(20,21)22)8(18)12(24-3)25-9-4(2-14)23-11(19)7(17)6(9)16/h3-19H,1-2H2,(H,20,21,22)/t3-,4-,5+,6-,7-,8-,9-,10+,11-,12+/m1/s1

1 reference

0 references

1 reference

5DUW (English)