(Q27139442)

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

7 October 2016

chemical formula

C₂₂H₃₈N₂O₁₆

1 reference

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

7 October 2016

canonical SMILES

CC(=O)NC1C(C(C(OC1O)COC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)CO)O)O)O)O)NC(=O)C)O)O

1 reference

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

7 October 2016

isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1O)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)NC(=O)C)O)O

1 reference

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

InChI=1S/C22H38N2O16/c1-6(27)23-11-15(31)14(30)10(37-20(11)35)5-36-21-12(24-7(2)28)16(32)19(9(4-26)39-21)40-22-18(34)17(33)13(29)8(3-25)38-22/h8-22,25-26,29-35H,3-5H2,1-2H3,(H,23,27)(H,24,28)/t8-,9-,10-,11-,12-,13+,14+,15-,16-,17+,18-,19-,20+,21-,22+/m1/s1

7 October 2016

Identifiers

InChI

1 reference

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

UOSDMMIGEKZXMK-YVDITIRXSA-N

7 October 2016

InChIKey

2 references

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

beta-D-Galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)-2-acetamido-2-deoxy-alpha-D-galactopyranose (English)

7 October 2016

2 references

Galbeta1-4GlcNAcbeta1-6GalNAcalpha (English)

matched by identifier from

7 October 2016

InChIKey

UOSDMMIGEKZXMK-YVDITIRXSA-N

ChEBI ID

71206

mapping relation type

2 references

beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)-alpha-D-GalpNAc (English)