Levodopa
fo-d980d19e34e9985a
Identity
- Type
- NeutralMolecule
- CAS
- 59-92-7
- EC
- 200-445-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.
What it is used for
1
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| plant growth regulator CHEBI:26155 | A chemical, natural or artificial, that can affect the rate of growth of a plant. | ChEBI |
Alternative labels
67- (-)-3,4-Dihydroxyphenylalanine
- (-)-3-(3,4-dihydroxyphenyl)-L-alanine
- (-)-dopa
- (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid
- (S)-2-Amino-3-(3,4-dihydroxyphenyl)propanoic acid
- (S)-3,4-Dihydroxyphenylalanine
- 3,4-Dihydroxy-L-phenylalanine
- 3,4-Dihydroxyphenyl-L-alanine
- 3,4-DIHYDROXYPHENYLALANINE
- 3-(3,4-Dihydroxyphenyl)-L-alanine
- 3-Hydroxy-L-tyrosine
- 3-Hydroxytyrosine
- Alanine, 3-(3,4-dihydroxyphenyl)-, L-
- Alphadopa
- Bendopa
- beta-(3,4-dihydroxyphenyl)-L-alanine
- beta-(3,4-dihydroxyphenyl)alanine
- Brocadopa
- Cidandopa
- DA
- Deadopa
- Dihydroxy-L-phenylalanine
- Dihydroxyphenylalanine
- DOPA
- Dopaflex
- Dopaidan
- Dopal
- Dopalina
- Dopar
- Doparkine
- Doparl
- Dopasol
- Dopaston
- Dopaston SE
- Dopastone
- Dopastral
- Dopicar
- Doprin
- Eldopal
- Eldopar
- Eldopatec
- Eurodopa
- Helfo-dopa
- Inbrija
- Insulamina
- L-(-)-Dopa
- L-3,4-Dihydroxyphenylalanine
- L-3-(3,4-Dihydroxyphenyl)alanine
- L-4,5-Dihydroxyphenylalanine
- L-beta-(3,4-Dihydroxyphenyl)alanine
- L-DOPA
- L-Tyrosine, 3-hydroxy-
- L-β-(3,4-Dihydroxyphenyl)-α-alanine
- Laradopa
- Larodopa
- Ledopa
- levodopum
- Levopa
- Maipedopa
- Parda
- Pardopa
- Syndopa
- Veldopa
- Weldopa
- β-(3,4-Dihydroxyphenyl)-L-alanine
- β-(3,4-Dihydroxyphenyl)-α-L-alanine
- β-(3,4-Dihydroxyphenyl)alanine
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | WTDRDQBEARUVNC-LURJTMIESA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1 |
| Isomeric SMILES string chemrof:isomeric_smiles_string | N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O |
| IUPAC name chemrof:IUPAC_name | (-)-3-(3,4-dihydroxyphenyl)-L-alanine |
| Molecular formula chemrof:molecular_formula | C9H11NO4 |
| Molecular mass chemrof:molecular_mass | 197.19 |
| Monoisotopic mass chemrof:monoisotopic_mass | 197.068808, 197.06881 |
| SMILES string chemrof:smiles_string | NC(Cc1ccc(O)c(O)c1)C(=O)O |
Known URLs
52Where 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:6060047 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=59-92-7 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=65170-01-6 | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:15765 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.000.405 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9023209 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB01235 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB01235 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:1567 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/1567 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=118381 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=759573 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1009 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:365846 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/46627O600J | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0000181 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.225H | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C00355 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D00059 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C00355 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D00059 | enrich_references.pubchem_identifier_url |
| knapsack | knapsack:C00001357 | enrich_references.chebi_xrefs |
| lincs.smallmolecule | lincs.smallmolecule:LSM-5481 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37120 | enrich_references.pubchem_identifier_url |
| MetaCyc | https://metacyc.org/compound?orgid=META&id=L-DIHYDROXY-PHENYLALANINE | enrich_references.chebi_xrefs |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C611 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:DAH_LFOH | enrich_references.chebi_xrefs |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA450213 | enrich_references.pubchem_identifier_url |
| pharos.nih.gov | https://pharos.nih.gov/ligands/H7AMHQ2Y882F | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL1009 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/6047 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=126624 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/18690870 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22491024 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22592937 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23038403 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23127496 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23196068 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23206800 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23211937 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23357114 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23389842 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23389938 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23390548 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/29438107 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8301021 | enrich_references.chebi_xrefs |
| reaxys | reaxys:2215169 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/6375 | enrich_references.pubchem_identifier_url |
| wikidata.org | https://www.wikidata.org/wiki/Q106345614 | enrich_references.pubchem_identifier_url |
| wikidata.org | https://www.wikidata.org/wiki/Q300989 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/L-DOPA | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/Levodopa | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| b5635b8a-88fe-4db9-8185-f7dbfe344b2b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 650858c4-d08b-48cf-8476-8a4578968147 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 2693e751-e2b9-4761-ade2-ff9854368b13 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7062e8c2-f501-4b83-8dcc-087387da0371 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 1971fa6f-7bea-4c3a-ac09-bb3f84594fa7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| dcbf31f9-edb0-4b86-9682-02c756ecf74c | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| a55c6f83-2f4b-49e2-a2bc-a6462230b42e | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| a6c06cc5-a5c5-4c19-a574-c24d7147642f | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 0e266e56-5e13-4e4b-91bb-ff858d25f72c | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 5c5d98d5-440d-472c-b1ab-1096c79f2677 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| f659f02b-b228-4bcc-aa45-90b3ca3bc9bc | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 078b16bd-d3d2-4728-a80b-bf554e4c1c0b | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| ff4bf3d2-e7ff-4af9-9bb6-348bbb0771da | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (59 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-d980d19e34e9985a",
"prefLabel": [
{
"@value": "Levodopa",
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{
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{
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{
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{
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{
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{
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{
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{
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},
{
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{
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},
{
"@value": "3-Hydroxy-L-tyrosine",
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},
{
"@value": "3-Hydroxytyrosine",
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}
},
{
"@value": "Alanine, 3-(3,4-dihydroxyphenyl)-, L-",
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}
},
{
"@value": "Alphadopa",
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],
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}
},
{
"@value": "Bendopa",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "beta-(3,4-dihydroxyphenyl)-L-alanine",
"@language": "en",
"@lang": "en",
"provenance": {
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],
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}
},
{
"@value": "beta-(3,4-dihydroxyphenyl)alanine",
"@language": "en",
"@lang": "en",
"provenance": {
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}
},
{
"@value": "Brocadopa",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Cidandopa",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:59-92-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "DA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:59-92-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Deadopa",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:59-92-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dihydroxy-L-phenylalanine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
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"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_15765"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Dihydroxyphenylalanine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:59-92-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "DOPA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:59-92-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dopaflex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dopaidan",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"https://commonchemistry.cas.org/detail?cas_rn=59-92-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
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