Nitrilotriacetic Acid
fo-19253a98d1a05690
Identity
- Type
- Neutral molecule
- CAS
- 139-13-9
- EC
- 205-355-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
33- (Bis-carboxymethyl-amino)-acetic acid
- 2-[Bis(carboxymethyl)amino]acetic acid
- 412: PN: WO2007070372 PAGE: 72 claimed protein
- Acetic acid, nitrilotri-
- alpha,alpha',alpha''-trimethylaminetricarboxylic acid
- Chelest NT
- Complexon I
- Dissolvine A
- Dissolvine AZ
- Glycine, N,N-bis(carboxymethyl)-
- Glycine-N,N-diacetic acid
- H3nta
- Hampshire NTA acid
- Komplexon I
- MeSH ID: D009571
- N(CH2-COOH)3
- N,N-bis(carboxymethyl)glycine
- nitrilo-2,2',2''-triacetic acid
- Nitrilo-2,2′,2′′-triacetic acid
- Nitrilo-N,N,N-triacetic acid
- Nitrilotriacetate
- Nitrilotriessigsaeure
- Nitrilotris(methylenecarboxylic acid)
- NTA
- Titriplex I
- tri(carboxymethyl)amine
- triglycine
- Triglycollamic acid
- Trilon AS
- Tris(carboxymethyl)amine
- Tris(hydroxycarbonylmethyl)amine
- Versene NTA acid
- α,α′,α′′-Trimethylaminetricarboxylic acid
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | MGFYIUFZLHCRTH-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13) |
| IUPAC name chemrof:IUPAC_name | Nitrilotriacetic Acid |
| Molecular formula chemrof:molecular_formula | C6H9NO6 |
| Molecular mass chemrof:molecular_mass | 191.139 |
| Monoisotopic mass chemrof:monoisotopic_mass | 191.042987, 191.04299 |
| SMILES string chemrof:smiles_string | O=C(O)CN(CC(=O)O)CC(=O)O |
Known URLs
25Where 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:1710776 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=139-13-9 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:44557 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.004.869 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.051.336 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1238 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6020939 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB03040 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB03040 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2121 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1234848 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:3726 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/KA90006V9D | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0255635 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.533J | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C14695 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C14695 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=52386 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44408 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:NTA | enrich_references.chebi_xrefs |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL1234848 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8758 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=018682 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q425340 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Nitrilotriacetic_acid | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 041fab1c-6556-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d6d-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 71494ac3-e11d-4657-86c8-fa107d6e8911 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d6c-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-8d6e-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d6b-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d69-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-96da-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d6a-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d70-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 08a91e70-3ddc-11dd-96db-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-8d6f-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 20a975d3672c015617d7a6f0a647d1a25e5d4276 | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| 08a91e70-3ddc-11dd-96d9-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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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": "Nitrilotriacetate",
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{
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},
{
"@value": "NTA",
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{
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{
"@value": "tri(carboxymethyl)amine",
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{
"@value": "triglycine",
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},
{
"@value": "Triglycollamic acid",
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{
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},
{
"@value": "Tris(carboxymethyl)amine",
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},
{
"@value": "Tris(hydroxycarbonylmethyl)amine",
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},
{
"@value": "Versene NTA acid",
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},
{
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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