Consensus flow list

(z)-tetradec-11-enylacetate

fo-a09371e4ac9f4c91

Identity

Type
NeutralMolecule
CAS
20711-10-8
EC
243-982-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for (z)-tetradec-11-enylacetate

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Alternative labels

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YJINQJFQLQIYHX-PLNGDYQASA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h4-5H,3,6-15H2,1-2H3/b5-4-
Isomeric SMILES string chemrof:isomeric_smiles_string CC/C=C\CCCCCCCCCCOC(C)=O
IUPAC name chemrof:IUPAC_name [(Z)-tetradec-11-enyl] acetate
Molecular formula chemrof:molecular_formula C16H30O2
Molecular mass chemrof:molecular_mass 254.414
Monoisotopic mass chemrof:monoisotopic_mass 254.22458
SMILES string chemrof:smiles_string CCC=CCCCCCCCCCCOC(C)=O

Known URLs

13

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=20711-10-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:179801 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.039.969 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.4519179.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3035266 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3181839 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U0U163294D enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J664E enrich_references.pubchem_identifier_url
LIPID MAPS https://www.lipidmaps.org/databases/lmsd/LMFA07010309 enrich_references.chebi_xrefs
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMFA07010309 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=3954 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5367692 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27290535 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bf254d10-b835-48a7-8f25-dc1feeaee2d3 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
1bcae4f1-7b4d-48fe-927c-88aa10608497 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e0746625-4137-4d9a-a635-32c025a44435 Environmental → Air → Indoor EF 3.1 kg 2
10c7b907-7638-40d6-8823-4a358cbe9f31 Environmental → Air → Long-term EF 3.1 kg 0
cf7699b4-c16a-4162-bbc1-99f77fdd7aa7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
85ced9c0-732e-40f5-9610-da257cb76b09 Environmental → Air → Unknown EF 3.1 kg 2
bff15d3d-301d-480d-b850-998934a35bed Environmental → Ground → Agricultural EF 3.1 kg 2
2c550d85-4e76-4249-a304-70b529121bf2 Environmental → Ground → Non-agricultural EF 3.1 kg 2
09a35e4a-e305-445a-b29e-3a8b7f219c2f Environmental → Ground → Unknown EF 3.1 kg 2
b06c04fe-8652-48bb-b889-15d816de04c8 Environmental → Water → Long-term EF 3.1 kg 0
73501a0f-1942-4c2d-aa2d-d1989deb65cc Environmental → Water → Ocean EF 3.1 kg 2
0f0cfe90-2c05-4bd0-a924-37fdeb4cc1e7 Environmental → Water → Surface water EF 3.1 kg 2
581a4bb3-b4aa-4b15-ae72-fb99670ba3b8 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
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