(Q76305037)

English

ethyl (E)-hept-2-enoate

chemical compound

In more languages

Statements

type of chemical entity

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biogenic acyclic ester

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156.115029752 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₉H₁₆O₂

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canonical SMILES

O=C(OCC)C=CCCCC

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isomeric SMILES

CCCC/C=C/C(=O)OCC

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Launaea resedifolia

1 reference

Chemical composition and antibacterial activity of the essential oils from Launaea resedifolia L

Identifiers

InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3/b8-7+

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CYLQPOIZDBIXFP-BQYQJAHWSA-N

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CAS Registry Number

1 reference

CYLQPOIZDBIXFP-BQYQJAHWSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=54340-72-6

1 reference

matched by identifier from

CYLQPOIZDBIXFP-BQYQJAHWSA-N

mapping relation type

2 references

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3/b8-7+

UniChem compound ID

1 reference

DSSTox substance ID

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matched by identifier from

CYLQPOIZDBIXFP-BQYQJAHWSA-N

DSSTOX compound identifier

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09.374

1 reference

CAS no.: 54340-72-6 (English)

23 January 2021

09.374

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

CYLQPOIZDBIXFP-BQYQJAHWSA-N

1 reference

matched by identifier from

CYLQPOIZDBIXFP-BQYQJAHWSA-N

Sitelinks

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