(Q27162801)

5S-hydroperoxy-18-HEPE (English)

9 October 2016

chemical formula

C₂₀H₂₉O₅⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCC(C=CC=CCC=CCC=CC=CC(CCCC(=O)[O-])OO)O

1 reference

5S-hydroperoxy-18-HEPE (English)

9 October 2016

isomeric SMILES

CCC(/C=C/C=C\C/C=C\C/C=C\C=C\[C@H](CCCC(=O)[O-])OO)O

1 reference

5S-hydroperoxy-18-HEPE (English)

InChI=1S/C20H30O5/c1-2-18(21)14-11-9-7-5-3-4-6-8-10-12-15-19(25-24)16-13-17-20(22)23/h3-4,7-12,14-15,18-19,21,24H,2,5-6,13,16-17H2,1H3,(H,22,23)/p-1/b4-3-,9-7-,10-8-,14-11+,15-12+/t18?,19-/m1/s1

9 October 2016

Identifiers

InChI

1 reference

5S-hydroperoxy-18-HEPE (English)

JIOJPWROWDJRKM-PJNQMQIHSA-M

9 October 2016

InChIKey

2 references

5S-hydroperoxy-18-HEPE (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

5S-hydroperoxy-18-HEPE (English)

9 October 2016

ChEBI ID

90826

mapping relation type

1 reference

https://www.swisslipids.org/#/downloads

(5S)-hydroperoxy-18-hydroxy-EPE(1-) (English)

9 October 2016

1 reference

1 reference