(Q27130235)

colneleate synthase activity

1 February 2021

1 reference

reference URL

http://geneontology.org/external2go/rhea2go

1 February 2021

mass

311.222234±0 dalton

1 reference

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

6 October 2016

1 reference

C₁₈H₃₁O₄⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCC=CC=CC(CCCCCCCC(=O)[O-])OO

1 reference

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

6 October 2016

isomeric SMILES

CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)[O-])OO

1 reference

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/p-1/b8-6-,14-11+/t17-/m1/s1

6 October 2016

Identifiers

InChI

1 reference

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

JGUNZIWGNMQSBM-UINYOVNOSA-M

6 October 2016

InChIKey

2 references

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(9S,10E,12Z)-9-Hydroperoxy-10,12-octadecadienoate (English)

6 October 2016

1 reference

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate (English)

6 October 2016

ChEBI ID

60955

mapping relation type

1 reference

Human Metabolome Database ID

9(S)-HPODE(1-) (English)

6 October 2016

1 reference

HMDB0303982

1 reference

based on heuristic

inferred from InChIKey

1 reference

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