Praziquantel
fo-f25450c2b1440dd4
Identity
- Type
- Neutral molecule
- CAS
- 55268-74-1
- EC
- 259-559-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
22- (+/-)-Praziquantel
- (11bR)-2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
- (±)-Praziquantel
- (±)-Praziquatel
- 2-(Cyclohexanecarbonyl)-2,3,6,7-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4(11bH)-one
- 2-(Cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one
- 2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one
- 2-Cyclohexanecarbonyl-1,2,3,6,7,11b-hexahydro-pyrazino[2,1-a]isoquinolin-4-one
- 4H-Pyrazino[2,1-a]isoquinolin-4-one, 2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-
- azinox
- Biltricide
- Cesol
- cysticide
- distocide
- Droncit
- Epiquantel
- Hada Clean
- MeSH ID: D011223
- prazinon
- pyquiton
- saniquantrel
- Warmnil
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | FSVJFNAIGNNGKK-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2 |
| IUPAC name chemrof:IUPAC_name | 2-(Cyclohexanecarbonyl)-2,3,6,7-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4(11bH)-one |
| Molecular formula chemrof:molecular_formula | C19H24N2O2 |
| Molecular mass chemrof:molecular_mass | 312.413 |
| Monoisotopic mass chemrof:monoisotopic_mass | 312.183778, 312.18378 |
| SMILES string chemrof:smiles_string | O=C(C1CCCCC1)N1CC(=O)N2CCc3ccccc3C2C1 |
Known URLs
26Where 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=55268-74-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:91583 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.054.126 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9021182 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB01058 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:2241 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/2241 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=757285 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL976 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6490C9U457 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0015191 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.787A | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J457.026J | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/C07367 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D00471 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-1387 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43296 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C47683 | enrich_references.pubchem_identifier_url |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA164764583 | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL976 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/4891 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=007943 | enrich_references.pubchem_identifier_url |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/8628 | enrich_references.pubchem_identifier_url |
| vsdb | vsdb:1782 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q424145 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Praziquantel | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 20cd768c-1bf3-4bdd-b05d-ca6f51ba8c3f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| cfc8e503-2bf2-43a6-ba21-38045ad606fb | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| d1b1b622-8cea-4c37-a443-d7ef0936235c | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 32cb38ca-a9d9-4718-8fb3-73c4b8f788a6 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7305f1f6-9f56-48b9-8d24-40de4f0837d7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| cf7ff034-dc2f-4214-9559-c0252bb18783 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 3579d5c4-cee6-4747-aa3a-e290ea5c9469 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 66ce6025-c779-4ebe-934a-0312873b7e20 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 1d841092-b4e3-42b8-ace5-36553d4ae69e | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 70af269f-2af9-46a1-9f08-a716e5d7ca9a | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| c0139806-8de6-4c9e-a10d-291d5403a777 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 616fdb68-18aa-4742-8d79-d7b889906f02 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 36c1d551-eaec-4650-8ff0-73508e6147ac | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works