Consensus flow list

3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan

fo-044182992db6a23e

Identity

Type
Neutral molecule
CAS
3738-00-9
EC
223-118-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YPZUZOLGGMJZJO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3
IUPAC name chemrof:IUPAC_name 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan
Molecular formula chemrof:molecular_formula C16H28O
Molecular mass chemrof:molecular_mass 236.399
Monoisotopic mass chemrof:monoisotopic_mass 236.214016, 236.21402
SMILES string chemrof:smiles_string CC1(C)CCCC2(C)C1CCC1(C)OCCC12

Known URLs

12

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=3738-00-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:171882 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.021.017 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.96437.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2048119 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3728760 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/1559-tetramethyl-13-oxatricyclo830049tridecane enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0036831 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J205.641K enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=47525 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/107166 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81976567 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
32b68bc8-adc5-46c1-90a8-8ce3a3d0ad20 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4b7add2d-7369-48a3-a54a-1e988abc72ea Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e3a97935-615b-44bc-a778-f0503ce3d93a Environmental → Air → Indoor EF 3.1 kg 2
20ea637c-7b33-4f66-8ece-5cbc14b407cf Environmental → Air → Long-term EF 3.1 kg 0
eaa64200-96b0-459f-9dc9-b02c003e3d40 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
cc84a07b-ea05-4536-9b84-2e70ebe64a15 Environmental → Air → Unknown EF 3.1 kg 2
a05ccfea-5fac-489e-8bb8-dc1afc7c5eec Environmental → Ground → Agricultural EF 3.1 kg 2
d66add59-d961-459e-84f7-41758d8ce5b4 Environmental → Ground → Non-agricultural EF 3.1 kg 2
84c13d4a-b6be-41b3-a6c0-92f838219870 Environmental → Ground → Unknown EF 3.1 kg 2
2cdb924c-0017-4394-a61a-1b9e015b5c89 Environmental → Water → Long-term EF 3.1 kg 0
cc575d99-785e-4d05-9729-8c1d4d9007dd Environmental → Water → Ocean EF 3.1 kg 2
36d84ab7-5a37-4525-a537-c7bcef259bf5 Environmental → Water → Surface water EF 3.1 kg 2
e4895789-07a8-44e0-8740-5f6d5ad9117d Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
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}

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