(Q27124688)

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

5-dehydro-4-deoxy-D-glucuronate

6 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₆H₇O₆⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C(C(C(C=O)O)O)C(=O)C(=O)[O-]

1 reference

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

6 October 2016

isomeric SMILES

C([C@@H]([C@@H](C=O)O)O)C(=O)C(=O)[O-]

1 reference

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

InChI=1S/C6H8O6/c7-2-5(10)3(8)1-4(9)6(11)12/h2-3,5,8,10H,1H2,(H,11,12)/p-1/t3-,5+/m0/s1

6 October 2016

Identifiers

InChI

1 reference

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

IMUGYKFHMJLTOU-WVZVXSGGSA-M

6 October 2016

InChIKey

2 references

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

4-Deoxy-L-erythro-hex-5-ulosuronate (English)

6 October 2016

1 reference

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate (English)

6 October 2016

ChEBI ID

57442

mapping relation type

1 reference