Consensus flow list

2-aminobutanedioic Acid

fo-92332e4d64c0b1e8

Identity

Type
Neutral molecule
CAS
617-45-8
EC
210-513-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for 2-aminobutanedioic Acid

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CKLJMWTZIZZHCS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)
IUPAC name chemrof:IUPAC_name 2-aminobutanedioic Acid
Molecular formula chemrof:molecular_formula C4H7NO4
Molecular mass chemrof:molecular_mass 133.103
Monoisotopic mass chemrof:monoisotopic_mass 133.037508, 133.03751
SMILES string chemrof:smiles_string NC(CC(=O)O)C(=O)O

Known URLs

21

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=27881-03-4 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=617-45-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:22660 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.009.559 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID30859003 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=141379 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=3973 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=620336 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=79553 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=97922 enrich_references.pubchem_identifier_url
gmelin gmelin:185140 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/28XF4669EP enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.278E enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C16433 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C16433 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/424 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=001654 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/22264337 enrich_references.chebi_xrefs
reaxys reaxys:774618 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27109481 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Aspartic_acid enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
8e6d79eb-4fe3-4113-8713-145ded9e670e Environmental → Air → Aircraft cruise height EF 3.1 kg 2
aa1d487f-dcd1-40fc-8701-50fef592547c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
95b61a42-794c-4c0d-965e-30e6d4a12258 Environmental → Air → Indoor EF 3.1 kg 2
9993c692-9539-4eed-b512-9a8bb118298a Environmental → Air → Long-term EF 3.1 kg 0
a95589c0-8764-47a3-aff1-43f565761d84 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
2d248039-ff57-4c0d-9250-a61bc67a29ad Environmental → Air → Unknown EF 3.1 kg 2
1f6442ef-e847-4e7c-99f6-5fa41964d3b7 Environmental → Ground → Agricultural EF 3.1 kg 2
7eb5b5f0-c8c7-4612-a933-ca1a39a0062d Environmental → Ground → Non-agricultural EF 3.1 kg 2
c9165c35-c649-40fa-bade-08e1990c0ee8 Environmental → Ground → Unknown EF 3.1 kg 2
077723dd-56b3-4968-8f7c-302e461aebcd Environmental → Water → Long-term EF 3.1 kg 0
82eba327-0cc2-4ef9-89d6-cc7cce211f60 Environmental → Water → Ocean EF 3.1 kg 2
e57fd92d-1462-4fb0-b850-d0f31a289f24 Environmental → Water → Surface water EF 3.1 kg 2
932c6c9a-f5ec-4166-9dba-fc627f384233 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
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