Malic acid
fo-2b6bf2a7d541f880
Identity
- Type
- Neutral molecule
- CAS
- 6915-15-7
- EC
- 230-022-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
Alternative labels
5- Aepfelsaeure
- alpha-hydroxysuccinic acid
- apple acid
- E296
- H2mal
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | BJEPYKJPYRNKOW-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9) |
| IUPAC name chemrof:IUPAC_name | Malic acid |
| Molecular formula chemrof:molecular_formula | C4H6O5 |
| Molecular mass chemrof:molecular_mass | 134.087 |
| Monoisotopic mass chemrof:monoisotopic_mass | 134.02152, 134.021523 |
| SMILES string chemrof:smiles_string | O=C(O)CC(O)C(=O)O |
Known URLs
35Where 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=6915-15-7 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=78644-42-5 | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:6650 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.009.560 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.027.293 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0027640 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB12751 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=25941 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1455497 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:3325 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/817L1N4CKP | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0000744 | enrich_references.chebi_xrefs |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2918.19.60.00 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.091K | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C00711 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D04843 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C00711 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/C03668 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D04843 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=123508 | enrich_references.pubchem_identifier_url |
| MetaCyc | https://metacyc.org/compound?orgid=META&id=RS-Malate | enrich_references.chebi_xrefs |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C80654 | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL1455497 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:1352 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/525 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/15767321 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17190852 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17439666 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17896933 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19743855 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22411507 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1723539 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/29209 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q190143 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Malic_acid | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ff319649-bdb5-4b38-b2f0-2f3c6102a896 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| b0a761b4-ddec-4367-a31e-03e09cda472f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| baeaf2dc-53d5-4db3-a4cc-26ca0f0de3b0 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| d9b580f4-f20b-4f1b-b8fc-762fef955e6f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| bf4c8168-bd3b-4441-bd57-7920616f2507 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d3973b1b-087f-4abd-9bc7-00b5c0a32a35 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 4f5ac82d-511a-4dc4-8e16-f5df25b664c2 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 04f71b8b-c074-4f45-847d-46e91d35c81e | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3e8d77f9-a7f4-4e5b-b792-9ba5998320da | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 323e7a34-43be-499f-9f01-0f88fa1fb3bd | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| dcf4c763-caaa-4685-bb42-3d0f90ed4ef6 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 7678a5ed-cb47-4a93-a1f9-d7e5fc469a4c | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| f4d46e58-6943-407a-9098-2dd68af1a31a | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (59 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