(Q27225433)

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

(8R)-hydroxy-(11R,12R)-epoxyicosa-(5Z,9E,14Z)-trienoate

12 October 2016

stereoisomer of

2 references

inferred from InChIKey

(8R)-hydroxy-(11S,12S)-epoxyicosa-(5Z,9E,14Z)-trienoate

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₂₀H₃₁O₄⁻

1 reference

inferred from SMILES

canonical SMILES

CCCCCC=CCC1C(O1)C=CC(CC=CCCCC(=O)[O-])O

1 reference

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

12 October 2016

isomeric SMILES

CCCCC/C=C\C[C@H]1[C@@H](O1)/C=C/[C@H](C/C=C\CCCC(=O)[O-])O

1 reference

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/p-1/b9-7-,10-6-,16-15+/t17-,18-,19-/m0/s1

12 October 2016

Identifiers

InChI

1 reference

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

SGTUOBURCVMACZ-JQGBYENFSA-M

12 October 2016

InChIKey

2 references

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

12 October 2016

stated in

ChEBI release 2020-09-01

2 references

(8S)-hydroxy-(11S,12S)-hepoxilin A3 (English)

matched by identifier from

12 October 2016

InChIKey

SGTUOBURCVMACZ-JQGBYENFSA-M

ChEBI ID

132129

mapping relation type

2 references

(8S)-hepoxilin A3(1-) (English)

matched by identifier from

12 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/p-1/b9-7-,10-6-,16-15+/t17-,18-,19-/m0/s1

1 reference

2 references

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