(Q27130252)

Colneleic acid (English)

6 October 2016

chemical formula

C₁₈H₃₀O₃

1 reference

Colneleic acid (English)

6 October 2016

canonical SMILES

CCCCCC=CC=COC=CCCCCCCC(=O)O

1 reference

Colneleic acid (English)

6 October 2016

isomeric SMILES

CCCCC/C=C\C=C\O/C=C/CCCCCCC(=O)O

1 reference

The enzymic conversion of linoleic acid into 9-(nona-1′,3′-dienoxy)non-8-enoic acid, a novel unsaturated ether derivative isolated from homogenates of Solanum tuberosum tubers

Colneleic acid (English)

6 October 2016

2 references

stated in

Stereospecific removal of the pro-R hydrogen at C-8 of (9S)-hydroperoxyoctadecadienoic acid in the biosynthesis of colneleic acid

Identifiers

InChI

InChI=1S/C18H30O3/c1-2-3-4-5-7-10-13-16-21-17-14-11-8-6-9-12-15-18(19)20/h7,10,13-14,16-17H,2-6,8-9,11-12,15H2,1H3,(H,19,20)/b10-7-,16-13+,17-14+

1 reference

Colneleic acid (English)

6 October 2016

2 references

Colneleic acid (English)

6 October 2016

stated in

ChEBI release 2020-09-01

2 references

colneleic acid (English)

6 October 2016

https://commonchemistry.cas.org/detail?cas_rn=52761-34-9

10 April 2021

1 reference

(8E)-9-[(1E,3Z)-1,3-Nonadien-1-yloxy]-8-nonenoic acid (English)

6 October 2016

1 reference

Colneleic acid (English)

6 October 2016

Reaxys registry number

3547052

1 reference

colneleic acid (English)

6 October 2016

ChEBI ID

60956

mapping relation type

2 references

colneleic acid (English)

6 October 2016

International Chemical Identifier

InChI

InChI=1S/C18H30O3/c1-2-3-4-5-7-10-13-16-21-17-14-11-8-6-9-12-15-18(19)20/h7,10,13-14,16-17H,2-6,8-9,11-12,15H2,1H3,(H,19,20)/b10-7-,16-13+,17-14+

1 reference

1 reference

Human Metabolome Database ID

HMDB0030995

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00000449

2 references

based on heuristic

inferred from InChIKey

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

1 reference