Consensus flow list

Identity

Type
Neutral molecule
CAS
123-75-1
EC
204-648-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Pyrrolidine

Alternative labels

11

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RWRDLPDLKQPQOW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H9N/c1-2-4-5-3-1/h5H,1-4H2
IUPAC name chemrof:IUPAC_name Pyrrolidine
Molecular formula chemrof:molecular_formula C4H9N
Molecular mass chemrof:molecular_mass 71.123
Monoisotopic mass chemrof:monoisotopic_mass 71.073499, 71.0735
SMILES string chemrof:smiles_string C1CCNC1

Known URLs

27

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
beilstein beilstein:102395 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=123-75-1 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=89014-29-9 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:33135 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.227 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1315 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.29008.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3059559 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB16858 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=62781 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL22830 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/pyrrolidine enrich_references.pubchem_identifier_url
foodb.food foodb.food:FDB007401 enrich_references.chebi_xrefs
gmelin gmelin:1704 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/LJU5627FYV enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0031641 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.931I enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=187685 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:VES enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31268 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1922 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/1221030 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18838771 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/20024446 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/2585446 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q408898 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Pyrrolidine enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
88a6d7c0-266c-4feb-921f-e79e0cd9ae12 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
bfdd6d1e-7361-49f3-91c6-959639d74b07 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
bb392d25-02aa-4134-9301-c6e36650da81 Environmental → Air → Indoor EF 3.1 kg 4
470966ca-eb40-494c-8fae-10efccef1f3f Environmental → Air → Long-term EF 3.1 kg 0
1db03c30-b52b-4c01-ba64-d6eb8d0e687f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
646da1c0-8ace-4924-b81b-88d545b9af1b Environmental → Air → Unknown EF 3.1 kg 4
c11e30df-57d9-4d57-ae4a-d7d8dbe56901 Environmental → Ground → Agricultural EF 3.1 kg 4
e6a301b7-7884-4ac8-a3b0-07149275c09d Environmental → Ground → Non-agricultural EF 3.1 kg 4
0094b009-087b-47af-95b8-f728684168e4 Environmental → Ground → Unknown EF 3.1 kg 4
3a35456f-e40e-40d2-a010-6fd5b274961a Environmental → Water → Long-term EF 3.1 kg 0
6dac122b-6e53-4285-809a-a50858dbcb8f Environmental → Water → Ocean EF 3.1 kg 4
d2925852-c92f-4650-8bd9-199f47d45d1e Environmental → Water → Surface water EF 3.1 kg 4
b3168d88-9b29-4134-90ab-8ece139635a6 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
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