(Q27140551)

GSL-1 from Sphingomonas spp (English)

7 October 2016

chemical formula

C₃₇H₇₃NO₉

1 reference

GSL-1 from Sphingomonas spp (English)

7 October 2016

canonical SMILES

CCCCCCCCCCCCCCCC(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)C(CCCCCCCCCCC)O)O

1 reference

GSL-1 from Sphingomonas spp (English)

7 October 2016

isomeric SMILES

CCCCCCCCCCCCCCC[C@H]([C@H](CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)NC(=O)[C@@H](CCCCCCCCCCC)O)O

1 reference

GSL-1 from Sphingomonas spp (English)

InChI=1S/C37H73NO9/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-30(40)29(28-46-37-35(44)34(43)33(42)32(27-39)47-37)38-36(45)31(41)26-24-22-20-17-12-10-8-6-4-2/h29-35,37,39-44H,3-28H2,1-2H3,(H,38,45)/t29-,30+,31+,32+,33+,34-,35+,37-/m0/s1

7 October 2016

Identifiers

InChI

1 reference

GSL-1 from Sphingomonas spp (English)

MNDKKVNFZQBCKZ-FPODLROFSA-N

7 October 2016

InChIKey

2 references

GSL-1 from Sphingomonas spp (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2R)-N-[(2S,3R)-1-(alpha-D-Glucopyranosyloxy)-3-hydroxy-2-octadecanyl]-2-hydroxytridecanamide (English)

7 October 2016

2 references

GSL-1 from Sphingomonas spp (English)

matched by identifier from

7 October 2016

InChIKey

MNDKKVNFZQBCKZ-FPODLROFSA-N

ChEBI ID

73466

mapping relation type

2 references

1-alpha-D-glucuronosyl-N-[(2R)-2-hydroxytridecanoyl]sphinganine (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C37H73NO9/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-30(40)29(28-46-37-35(44)34(43)33(42)32(27-39)47-37)38-36(45)31(41)26-24-22-20-17-12-10-8-6-4-2/h29-35,37,39-44H,3-28H2,1-2H3,(H,38,45)/t29-,30+,31+,32+,33+,34-,35+,37-/m0/s1

1 reference

1 reference

Immune Epitope Database and Analysis Resource

IEDB Epitope ID

187231