N-glycoloylneuraminate (Q27104037)

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

5 October 2016

chemical formula

C₁₁H₁₈NO₁₀⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1C(C(C(OC1(C(=O)[O-])O)C(C(CO)O)O)NC(=O)CO)O

1 reference

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

5 October 2016

isomeric SMILES

C1[C@@H]([C@H]([C@@H](OC1(C(=O)[O-])O)[C@@H]([C@@H](CO)O)O)NC(=O)CO)O

1 reference

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

InChI=1S/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/p-1/t4-,5+,7+,8+,9+,11?/m0/s1

5 October 2016

Identifiers

InChI

1 reference

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

FDJKUWYYUZCUJX-PGIATKPXSA-M

5 October 2016

InChIKey

2 references

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(6R)-3,5-Dideoxy-5-(glycoloylamino)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-ulopyranosonate (English)

5 October 2016

2 references

3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-D-galacto-non-2-ulopyranosonate (English)

matched by identifier from

5 October 2016

InChIKey

FDJKUWYYUZCUJX-PGIATKPXSA-M

ChEBI ID

29025

mapping relation type

2 references

N-glycoloylneuraminate (English)