(2E,4E)-2,4-heptadienal (Q27292092)

trans,trans-2,4-Heptadienal (English)

18 November 2016

chemical formula

C₇H₁₀O

1 reference

trans,trans-2,4-Heptadienal (English)

18 November 2016

canonical SMILES

CCC=CC=CC=O

1 reference

trans,trans-2,4-Heptadienal (English)

18 November 2016

isomeric SMILES

CC/C=C/C=C/C=O

1 reference

trans,trans-2,4-Heptadienal (English)

18 November 2016

found in taxon

Vaccinium macrocarpon

1 reference

The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.

Vaccinium vitis-idaea

1 reference

The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.

Rosmarinus officinalis

1 reference

Phytochemical Profiling of Flavonoids, Phenolic Acids, Terpenoids, and Volatile Fraction of a Rosemary (Rosmarinus officinalis L.) Extract.

Perilla frutescens

1 reference

Characteristic aroma-active compounds of Korean perilla (Perilla frutescens Britton) leaf

Nicotiana tabacum

3 references

A Chemical Study of Burley Tobacco Flavour (Nicotiana tabacum L.). I. Volatile to medium-volatile constituents (b.p. ≦ 84°/0.001 Torr

Extraction of essential oil from discarded tobacco leaves by solvent extraction and steam distillation, and identification of its chemical composition

Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves

tomato

1 reference

Effect of autochthonous lactic acid bacteria starters on health-promoting and sensory properties of tomato juices

Camellia sinensis

1 reference

Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents

Identifiers

InChI

InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+

1 reference

trans,trans-2,4-Heptadienal (English)

18 November 2016

2 references

trans,trans-2,4-Heptadienal (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

4313-03-5

2 references

Global Substance Registration System

(2E,4E)-2,4-heptadienal (English)

18 November 2016

https://commonchemistry.cas.org/detail?cas_rn=4313-03-5

10 April 2021

1 reference

(E,E)-2,4-Heptadienal (English)

18 November 2016

2 references

trans,trans-2,4-Heptadienal (English)

18 November 2016

ChEBI ID

132837

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+

1 reference

2,4-HEPTADIENAL (English)

18 November 2016

2 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008208

1 reference

MassBank accession ID

0 references

SPLASH

splash10-001i-9000000000-e09a08215877716d57dd

0 references

DSSTox substance ID

DTXSID60872846

2 references

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

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

(2E,4E)-2,4-heptadienal (English)

ECHA Substance Infocard ID

18 November 2016

100.022.117

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.022.117

27 December 2018

Human Metabolome Database ID

(2E,4E)-hepta-2,4-dienal (English)

quotation

CAS no.: 4313-03-5 (English)

FL number

05.084

1 reference

quotation

CAS no.: 4313-03-5 (English)

23 January 2021

05.084

1 reference

28 December 2019

HEPTADIENAL (English)

quotation

CAS no.: 4313-03-5 (English)

1 reference

HMDB0303844

2 references

based on heuristic

KNApSAcK ID

C00053838

2 references

based on heuristic

C00055578

2 references

based on heuristic

2 references

Global Substance Registration System

(2E,4E)-2,4-heptadienal (English)

18 November 2016

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

1 reference

30 June 2018

JECFA number

1179

1 reference

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)