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alpha-Amino-1H-1,2,4-triazole-5-propanoic acid

UUID 161b15d0-92e6-426b-9055-549791d0fbb9
Flow Object IDfo-ce5067fd3f34a9f2
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 10109-05-4
EC Numbers 233-301-2
prefLabel
Language Value Provenance
en alpha-Amino-1H-1,2,4-triazole-5-propanoic acid
altLabel ⓘ
Language Value Provenance
en 1,2,4-Triazole-3-alanine
en 3-(1,2,4-triazol-3-yl)alanine
en 3-(1H-1,2,4-triazol-3-yl)alanine
en alpha-Amino-1H-1,2,4-triazole-3-propanoic acid
en 1,2,4-Triazole-3-<span class="text-smallcaps">DL</span>-alanine
en 1,2,4-Triazole-<span class="text-smallcaps">DL</span>-alanine
en 1<em>H</em>-1,2,4-Triazole-3-propanoic acid, α-amino-
en 1<em>H</em>-1,2,4-Triazole-5-propanoic acid, α-amino-
en 2-Amino-3-(1<em>H</em>-1,2,4-triazol-5-yl)propanoic acid
en 2-Amino-3-(4<em>H</em>-1,2,4-triazol-3-yl)propanoic acid
en 3-(1,2,4-Triazol-3-yl)-<span class="text-smallcaps">D</span>,L-alanine
en <em>s</em>-Triazole-3-alanine
en <em>s</em>-Triazole-3-propionic acid, α-amino-
en NSC 76227
en α-Amino-1<em>H</em>-1,2,4-triazole-5-propanoic acid
en 1,2,4-triazolyl-3-alanine
Definitions
Language Value Provenance
en A non-proteinogenic α-amino acid that is alanine in which one of the methyl hydrogens is replaced by a 1,2,4-triazol-3-yl group.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey CAPORZWUTKSILW-UHFFFAOYSA-N
InChI InChI=1S/C5H8N4O2/c6-3(5(10)11)1-4-7-2-8-9-4/h2-3H,1,6H2,(H,10,11)(H,7,8,9)
IUPAC name 2-amino-3-(1H-1,2,4-triazol-5-yl)propanoic acid, 2-amino-3-(1H-1,2,4-triazol-5-yl)propionic acid, 2-azanyl-3-(1H-1,2,4-triazol-5-yl)propanoic acid
Molecular formula C5H8N4O2
Molecular mass 156.145
Monoisotopic mass 156.06473
SMILES C1=NNC(=N1)CC(C(=O)O)N, NC(Cc1ncnn1)C(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 161b15d0-92e6-426b-9055-549791d0fbb9 1,2,4-triazolyl-3-alanine

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1,2,4-triazolyl-3-alanine Emissions/Emissions to water/Emissions to water, unspecified kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=1,2,4-triazolyl-3-alanine||dimension=Environmental > media=Water > water_body=Surface water; cas=10109-05-4; added Common Chemistry CAS names as altLabel: 1,2,4-Triazole-3-<span class="text-smallcaps">DL</span>-alanine, 1,2,4-Triazole-<span class="text-smallcaps">DL</span>-alanine, 1<em>H</em>-1,2,4-Triazole-3-propanoic acid, α-amino-, 1<em>H</em>-1,2,4-Triazole-5-propanoic acid, α-amino-, 2-Amino-3-(1<em>H</em>-1,2,4-triazol-5-yl)propanoic acid, 2-Amino-3-(4<em>H</em>-1,2,4-triazol-3-yl)propanoic acid, 3-(1,2,4-Triazol-3-yl)-<span class="text-smallcaps">D</span>,L-alanine, <em>s</em>-Triazole-3-alanine, <em>s</em>-Triazole-3-propionic acid, α-amino-, NSC 76227, α-Amino-1<em>H</em>-1,2,4-triazole-5-propanoic acid; object_uuid=fo-ce5067fd3f34a9f2
cas_match_labels 1 — consensus_match group_key=1,2,4-triazolyl-3-alanine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'10109-05-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ce5067fd3f34a9f2: {'10109-05-4': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1,2,4-Triazole-3-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1,2,4-Triazole-3-alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-(1,2,4-triazol-3-yl)alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-(1,2,4-triazol-3-yl)alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-(1H-1,2,4-triazol-3-yl)alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-(1H-1,2,4-triazol-3-yl)alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-Amino-1H-1,2,4-triazole-3-propanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-Amino-1H-1,2,4-triazole-3-propanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1,2,4-Triazole-3-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1,2,4-Triazole-3-alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-(1,2,4-triazol-3-yl)alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-(1,2,4-triazol-3-yl)alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-(1H-1,2,4-triazol-3-yl)alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-(1H-1,2,4-triazol-3-yl)alanine', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-Amino-1H-1,2,4-triazole-3-propanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-Amino-1H-1,2,4-triazole-3-propanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_9675', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1,2,4-Triazole-3-<span class="text-smallcaps">DL</span>-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2,4-Triazole-<span class="text-smallcaps">DL</span>-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1<em>H</em>-1,2,4-Triazole-3-propanoic acid, α-amino-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1<em>H</em>-1,2,4-Triazole-5-propanoic acid, α-amino-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Amino-3-(1<em>H</em>-1,2,4-triazol-5-yl)propanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Amino-3-(4<em>H</em>-1,2,4-triazol-3-yl)propanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-(1,2,4-Triazol-3-yl)-<span class="text-smallcaps">D</span>,L-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>s</em>-Triazole-3-alanine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>s</em>-Triazole-3-propionic acid, α-amino-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 76227', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Amino-1<em>H</em>-1,2,4-triazole-5-propanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10109-05-4', 'https://commonchemistry.cas.org/detail?cas_rn=10109-05-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1,2,4-triazolyl-3-alanine||dimension=Environmental > media=Water > water_body=Surface water; cas=10109-05-4; added Common Chemistry CAS names as altLabel: 1,2,4-Triazole-3-<span class="text-smallcaps">DL</span>-alanine, 1,2,4-Triazole-<span class="text-smallcaps">DL</span>-alanine, 1<em>H</em>-1,2,4-Triazole-3-propanoic acid, α-amino-, 1<em>H</em>-1,2,4-Triazole-5-propanoic acid, α-amino-, 2-Amino-3-(1<em>H</em>-1,2,4-triazol-5-yl)propanoic acid, 2-Amino-3-(4<em>H</em>-1,2,4-triazol-3-yl)propanoic acid, 3-(1,2,4-Triazol-3-yl)-<span class="text-smallcaps">D</span>,L-alanine, <em>s</em>-Triazole-3-alanine, <em>s</em>-Triazole-3-propionic acid, α-amino-, NSC 76227, α-Amino-1<em>H</em>-1,2,4-triazole-5-propanoic acid; object_uuid=fo-ce5067fd3f34a9f2
cas_match_labels None {'10109-05-4': 'exactMatch'} group_key=1,2,4-triazolyl-3-alanine||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'10109-05-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ce5067fd3f34a9f2: {'10109-05-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "name": null,
  "cas_numbers": [
    "10109-05-4"
  ],
  "ec_numbers": [
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  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "method_uuid": "7cfdcfcf-b222-4b26-888a-a55f9fbf7ac8",
      "name": "Human toxicity, non-cancer",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
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      "characterization_factor": 5.5327e-8
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    {
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      "name": "Human toxicity, non-cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 5.5327e-8
    }
  ],
  "source": "EF 3.1",
  "identifier": "161b15d0-92e6-426b-9055-549791d0fbb9",
  "input_datasets": [
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      "source_flow_name": "1,2,4-triazolyl-3-alanine",
      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to water, unspecified"
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