(Q27275929)

Propyl 2,4-decadienoate (English)

14 October 2016

chemical formula

C₁₃H₂₂O₂

1 reference

Propyl 2,4-decadienoate (English)

14 October 2016

canonical SMILES

CCCCCC=CC=CC(=O)OCCC

1 reference

Propyl 2,4-decadienoate (English)

14 October 2016

isomeric SMILES

CCCCC/C=C/C=C/C(=O)OCCC

1 reference

Propyl 2,4-decadienoate (English)

InChI=1S/C13H22O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h8-11H,3-7,12H2,1-2H3/b9-8+,11-10+

14 October 2016

Identifiers

InChI

1 reference

Propyl 2,4-decadienoate (English)

14 October 2016

1 reference

Global Substance Registration System

Propyl 2,4-decadienoate (English)

14 October 2016

1 reference

UNII

D07SW1IHHP

(2E,4E)-propyl 2,4-decadienoate (English)

14 October 2016

1 reference

Propyl (2E,4E)-2,4-decadienoate (English)

14 October 2016

2 references

Propyl 2,4-decadienoate (English)

14 October 2016

ChEBI ID

174069

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C13H22O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h8-11H,3-7,12H2,1-2H3/b9-8+,11-10+

1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID40106833

0 references

Human Metabolome Database ID

HMDB0037307

2 references

based on heuristic

inferred from InChIKey

Global Substance Registration System

UNII

D07SW1IHHP

2 references

stated in

UNII

D07SW1IHHP

(2E,4E)-propyl 2,4-decadienoate (English)

14 October 2016

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

1 reference