4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp2Me-(1->2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp-(1->2)-4,6-dideoxy-4-(3-deoxy-L-glycero-tetronamido)-alpha-D-Manp (Q27104805)

CHEBI:52982 (English)

5 October 2016

chemical formula

C₃₁H₅₅N₃O₁₉

1 reference

CHEBI:52982 (English)

5 October 2016

canonical SMILES

CC1C(C(C(C(O1)O)OC2C(C(C(C(O2)C)NC(=O)C(CCO)O)O)OC3C(C(C(C(O3)C)NC(=O)C(CCO)O)O)OC)O)NC(=O)C(CCO)O

1 reference

CHEBI:52982 (English)

5 October 2016

isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O[C@@H]2[C@H]([C@H]([C@@H]([C@H](O2)C)NC(=O)[C@H](CCO)O)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)NC(=O)[C@H](CCO)O)O)OC)O)NC(=O)[C@H](CCO)O

1 reference

CHEBI:52982 (English)

InChI=1S/C31H55N3O19/c1-11-17(32-26(44)14(38)5-8-35)20(41)23(29(47)49-11)52-31-25(22(43)19(13(3)51-31)34-28(46)16(40)7-10-37)53-30-24(48-4)21(42)18(12(2)50-30)33-27(45)15(39)6-9-36/h11-25,29-31,35-43,47H,5-10H2,1-4H3,(H,32,44)(H,33,45)(H,34,46)/t11-,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23+,24+,25+,29+,30-,31-/m1/s1

5 October 2016

Identifiers

InChI

1 reference

CHEBI:52982 (English)

QLIUTTKWFPAPOF-BUMMBSEUSA-N

5 October 2016

InChIKey

2 references

CHEBI:52982 (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

4,6-Dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-2-O-methyl-alpha-D-mannopyranosyl-(1->2)-4,6-dideoxy-4-{[(2S)-2,4-dihydroxybutanoyl]amino}-alpha-D-mannopyranosyl-(1->2)-4,6-dideoxy-4-{[(2S)-2,4-dihy (English)

5 October 2016

1 reference

CHEBI:52982 (English)

5 October 2016

ChEBI ID

52982

mapping relation type

1 reference