Consensus flow list

DL-2-amino-4-(ethylthio)butyric Acid

fo-f14a8a0334335a33

Identity

Type
Neutral molecule
CAS
67-21-0
EC
200-647-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
66 across every transformer

Structure

Structure diagram for DL-2-amino-4-(ethylthio)butyric Acid

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string GGLZPLKKBSSKCX-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H13NO2S/c1-2-10-4-3-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)
IUPAC name chemrof:IUPAC_name DL-2-amino-4-(ethylthio)butyric Acid, Dl-2-amino-4-(ethylthio)butyric Acid
Molecular formula chemrof:molecular_formula C6H13NO2S
Molecular mass chemrof:molecular_mass 163.242
Monoisotopic mass chemrof:monoisotopic_mass 163.0667
SMILES string chemrof:smiles_string CCSCCC(N)C(=O)O

Known URLs

30

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=67-21-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:68662 enrich_references.chebi_id_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:68664 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.588 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0020579 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=751 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=82393 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=97927 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1998607 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/92AK1Y27MZ enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251518 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.280B enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=ETHIONINE enrich_references.chebi_xrefs
patent patent:US2840587 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6205 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=018780 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/106781 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/13906694 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23867992 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/3395998 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6030278 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6286383 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/65785 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6744518 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7005506 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7225163 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/912478 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/975026 enrich_references.chebi_xrefs
reaxys reaxys:1722529 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27137089 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d86c88f4-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4d9a8790-3ddd-11dd-9048-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
8b8ac87f-6dae-4a8c-be8b-5f9662fd85b6 Environmental → Air → Indoor EF 3.1 kg 2
4d9a8790-3ddd-11dd-9047-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9b66-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
4d9a8790-3ddd-11dd-9046-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-9044-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-9d7b-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-9045-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-9b68-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9d7c-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
08a91e70-3ddc-11dd-9b67-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-9b69-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (66 changes)

Open the changes page

Full record

Flow object JSON 
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