Consensus flow list

Identity

Type
Chemical salt
CAS
3344-18-1
EC
222-093-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Trimagnesium Dicitrate

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string PLSARIKBYIPYPF-UHFFFAOYSA-H
InChI2D string chemrof:inchi2d_string InChI=1S/2C6H8O7.3Mg/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;;3*+2/p-6
IUPAC name chemrof:IUPAC_name Trimagnesium Dicitrate
Molecular formula chemrof:molecular_formula 2C6H5O7.3Mg, C12H10Mg3O14
Molecular mass chemrof:molecular_mass 451.113
Monoisotopic mass chemrof:monoisotopic_mass 449.96218
SMILES string chemrof:smiles_string O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Mg+2].[Mg+2].[Mg+2]

Known URLs

18

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=3344-18-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:131391 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.020.086 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.029.021 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID601015151 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB11110 enrich_references.pubchem_identifier_url
drugcentral.org https://drugcentral.org/drugcard/4281 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3989480 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/RHO26O1T9V enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D03265 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C29241 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL3989480 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6099959 enrich_references.pubchem_compound
reaxys reaxys:6674777 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/52356 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q4177438 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Magnesium_citrate enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Magnesium_citrate_(3:2) enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
37ba5af7-981c-40cb-ba70-096a5ba968cd Environmental → Air → Aircraft cruise height EF 3.1 kg 2
da5ab6d4-9f4e-4586-a402-3d0bfc1100fb Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
9409ee07-10d6-4cb1-8082-2b53eb1343a2 Environmental → Air → Indoor EF 3.1 kg 2
a56a4d1b-e30c-490e-97cd-98f550b5d885 Environmental → Air → Long-term EF 3.1 kg 0
1835a63d-a3e4-4b84-a80a-c95aace4c19f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
94153b5e-a716-4b12-8c04-bfc3e2e6abb3 Environmental → Air → Unknown EF 3.1 kg 2
5c34458d-0934-4b31-bae9-96986f136f36 Environmental → Ground → Agricultural EF 3.1 kg 2
83b215a1-1a5f-48b5-b54c-742b542cf83e Environmental → Ground → Non-agricultural EF 3.1 kg 2
8fb12b48-6960-474a-825d-faf423581560 Environmental → Ground → Unknown EF 3.1 kg 2
190575cb-5f5e-4c40-a0d3-371d7fd0de98 Environmental → Water → Long-term EF 3.1 kg 0
c1be01e4-e423-43a9-a671-c56cf14d33ed Environmental → Water → Ocean EF 3.1 kg 2
2fe12c17-00cd-4eb5-84ac-190e9fedc349 Environmental → Water → Surface water EF 3.1 kg 2
05c5b11d-409f-416b-97e0-064799aab307 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
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