(Q27160340)

alpha-12(13)-EpODE (English)

9 October 2016

chemical formula

C₁₈H₃₀O₃

1 reference

alpha-12(13)-EpODE (English)

9 October 2016

canonical SMILES

CCC=CCC1C(O1)CC=CCCCCCCCC(=O)O

1 reference

alpha-12(13)-EpODE (English)

9 October 2016

isomeric SMILES

CC/C=C\CC1C(O1)C/C=C\CCCCCCCC(=O)O

1 reference

alpha-12(13)-EpODE (English)

InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h3,8,10-11,16-17H,2,4-7,9,12-15H2,1H3,(H,19,20)/b10-3-,11-8-

9 October 2016

Identifiers

InChI

1 reference

alpha-12(13)-EpODE (English)

BKKGUKSHPCTUGE-OOHFSOINSA-N

9 October 2016

InChIKey

2 references

alpha-12(13)-EpODE (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(9Z)-11-{3-[(2Z)-2-Penten-1-yl]-2-oxiranyl}-9-undecenoic acid (English)

9 October 2016

1 reference

alpha-12(13)-EpODE (English)

9 October 2016

ChEBI ID

88462

mapping relation type

1 reference

Human Metabolome Database ID

A-12(13)-EpODE (English)

9 October 2016

1 reference

HMDB0010200

1 reference

based on heuristic

inferred from InChIKey

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download