Consensus flow list

Identity

Type
Neutral molecule
CAS
34661-75-1
EC
252-130-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Urapidil

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ICMGLRUYEQNHPF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H29N5O3/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3/h4-5,7-8,15,21H,6,9-14H2,1-3H3
IUPAC name chemrof:IUPAC_name 2,4(1H,3H)-Pyrimidinedione, 6-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-
Molecular formula chemrof:molecular_formula C20H29N5O3
Molecular mass chemrof:molecular_mass 387.484
Monoisotopic mass chemrof:monoisotopic_mass 387.22704
SMILES string chemrof:smiles_string COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1

Known URLs

22

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=34661-75-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:32278 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.047.377 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9021425 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB12661 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2796 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2796 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=310405 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL279229 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/A78GF17HJS enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0259712 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J19.690H enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D01333 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/D01333 enrich_references.pubchem_identifier_url
lincs.smallmolecule lincs.smallmolecule:LSM-5807 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=153607 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C152806 enrich_references.pubchem_identifier_url
pharos.nih.gov https://pharos.nih.gov/ligands/GPGPTFAXVNQ7 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL279229 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5639 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q418922 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Urapidil enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bbff8eda-3f16-4494-9822-f57a6d1f32eb Environmental → Air → Aircraft cruise height EF 3.1 kg 0
107d6d7f-9581-471f-a535-c9a8202d3b7b Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
96713bb3-7041-4beb-a6e8-a5263333bd50 Environmental → Air → Indoor EF 3.1 kg 0
80819b0c-e3ac-42c1-98be-a35b446c42bb Environmental → Air → Long-term EF 3.1 kg 0
aee81316-aadc-42a6-a44d-68fe1d093f1b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
de2afafe-beb4-4ed1-bc03-1e1802253ffc Environmental → Air → Unknown EF 3.1 kg 0
62878c6c-228e-4aec-be64-f4a124361193 Environmental → Ground → Agricultural EF 3.1 kg 0
798fd80a-d258-4b07-b007-7df835bfcd3f Environmental → Ground → Non-agricultural EF 3.1 kg 0
31d68253-4196-4e9b-8d83-b7ca91a0adfa Environmental → Ground → Unknown EF 3.1 kg 0
7680d157-4123-4a24-a58f-143abec5cdc4 Environmental → Water → Long-term EF 3.1 kg 0
da406132-48c6-4a30-9cf6-3c3f37f301f6 Environmental → Water → Ocean EF 3.1 kg 0
6e42f403-0884-450a-978c-94f1a20a109f Environmental → Water → Surface water EF 3.1 kg 0
193d0da6-d3de-4164-b684-0194998e890b Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-77d2ed349ace33e0",
  "prefLabel": [
    {
      "@value": "Urapidil",
      "@language": "en",
      "@lang": "en",
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  ],
  "altLabel": [
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      }
    },
    {
      "@value": "6-[[3-[4-(2-Methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione",
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    {
      "@value": "BKU",
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    },
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    {
      "@value": "eupressyl",
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    },
    {
      "@value": "mediatensyl",
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    },
    {
      "@value": "urapidil HCl",
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    },
    {
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    },
    {
      "@value": "uraprene",
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    },
    {
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