Sodium ascorbate
fo-c4df9b5072eb18ce
Identity
- Type
- ChemicalSalt
- CAS
- 134-03-2
- EC
- 205-126-1
- 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.
Alternative labels
31- 3-Oxo-L-gulofuranolactone sodium
- ascorbate de sodium
- ascorbic acid sodium salt
- Ascorbic acid, sodium deriv.
- Ascorbicin
- Ascorbin
- ASK-P 10KR
- Cebitate
- Cenolate
- Iskia C
- L-ascorbic acid sodium salt
- L-ascorbic acid, monosodium salt
- L-Ascorbic acid, sodium salt (1:1)
- Limcee
- Monosodium ascorbate
- monosodium L-ascorbate
- Natrascorb
- Natri-C
- natrii ascorbas
- Sodascorbate
- Sodium (+)-L-ascorbate
- sodium (2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olate
- Sodium (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one
- Sodium 2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olate
- Sodium 2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olate (non-preferred Name)
- Sodium L-(+)-ascorbate
- sodium L-ascorbate
- Vitamin C Na
- Vitamin C Na salt
- vitamin C sodium
- vitamin C, sodium salt
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | PPASLZSBLFJQEF-RXSVEWSESA-M |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H8O6.Na/c7-1-2(8)5-3(9)4(10)6(11)12-5;/h2,5,7-10H,1H2;/q;+1/p-1/t2-,5+;/m0./s1 |
| Isomeric SMILES string chemrof:isomeric_smiles_string | O=C1O[C@H]([C@@H](O)CO)C([O-])=C1O.[Na+] |
| IUPAC name chemrof:IUPAC_name | Sodium ascorbate |
| Molecular formula chemrof:molecular_formula | C6H7NaO6, C6H7O6.Na |
| Molecular mass chemrof:molecular_mass | 198.106 |
| Monoisotopic mass chemrof:monoisotopic_mass | 198.01403, 198.014032 |
| SMILES string chemrof:smiles_string | O=C1OC(C(O)CO)C([O-])=C1O.[Na+] |
Known URLs
31Where 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=134-03-2 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:113451 | enrich_references.chebi_id_link |
| ChemSpider | https://www.chemspider.com/Chemical-Structure.16736174.html | enrich_references.chebi_xrefs |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0020105 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB14482 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB14482 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL591665 | enrich_references.pubchem_identifier_url |
| foodb.food | foodb.food:FDB001226 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S033EH8359 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.221C | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/D05853 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=143187 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C82322 | enrich_references.pubchem_identifier_url |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA166163262 | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL591665 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/23667548 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26386330 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26755225 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26818978 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27011749 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/29669302 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/30352326 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/30902302 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/32172678 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/33474574 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/33573953 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/34151070 | enrich_references.chebi_xrefs |
| reaxys | reaxys:5465157 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/267366 | enrich_references.pubchem_identifier_url |
| wikidata.org | https://www.wikidata.org/wiki/Q424551 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Sodium_ascorbate | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 15da3f03-ec13-4c5c-aec7-68825a8fd99f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| cc1a6976-d134-43b4-821c-e99d5d5b5204 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 97634eee-ee87-44f1-b49c-259cf66a8821 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 288a4f8a-f62e-4cc3-9197-18d2b7df1868 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 0187b13b-c8af-4a48-b86f-2e1cd6902d9d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 27a286eb-043a-4890-9925-11a7230db256 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 859d5a0a-35a6-4e0f-aacf-b64e3d5938a9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| b1a1d34b-5135-4908-8e79-c3b6b867f99a | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| b085b7f8-84ae-495c-a6d9-cddb908b0192 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 59f981df-442b-4a14-87f7-b26b385a48de | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| cb97dc8d-5df5-43e7-be67-18ea94ed9409 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| f22d3194-79b7-49a9-ba79-5e968d489214 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 7c0bc3a2-3732-4aa0-a010-1d1a6fa1c1e7 | 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-c4df9b5072eb18ce",
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{
"@value": "Sodium ascorbate",
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"altLabel": [
{
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},
{
"@value": "ascorbate de sodium",
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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": "Cenolate",
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},
{
"@value": "Iskia C",
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},
{
"@value": "L-ascorbic acid sodium salt",
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{
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},
{
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}
},
{
"@value": "Limcee",
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}
},
{
"@value": "Monosodium ascorbate",
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},
{
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},
{
"@value": "Natrascorb",
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}
},
{
"@value": "Natri-C",
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},
{
"@value": "natrii ascorbas",
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},
{
"@value": "Sodascorbate",
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}
},
{
"@value": "Sodium (+)-L-ascorbate",
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}
},
{
"@value": "sodium (2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olate",
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},
{
"@value": "Sodium (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one",
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},
{
"@value": "Sodium 2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-olate",
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},
{
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{
"@value": "Sodium L-(+)-ascorbate",
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},
{
"@value": "sodium L-ascorbate",
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},
{
"@value": "Vitamin C Na",
"@language": "en",
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}
},
{
"@value": "Vitamin C Na salt",
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}
},
{
"@value": "vitamin C sodium",
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},
{
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],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C6H7NaO6",
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],
"attested_by": {
"C6H7O6.Na": [
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],
"C6H7NaO6": [
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},
"rdfs:label": "Molecular formula",
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"http://purl.obolibrary.org/obo/CHEBI_113451"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@type": [
"https://w3id.org/chemrof/ChemicalSalt"
]
}