Brightway Flows 1.0
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By field

13 fields
Field Changes Written by Latest note
properties 6 enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus the substance's answer, copied onto its flow
altLabel 3 chebi_altlabels, consensus_match, strip_catalogue_altlabels Removed 7 catalogue altLabel value(s): 'AA 2500' (grade code), 'Andro 100' (trade name), 'CDB 111C' (grade code), 'COL 1621' (grade code), 'CP 601B' (grade code), 'LPCN 1144' (grade code), 'NSC 9700' (registry code)
prefLabel 2 bootstrap_labels, normalize_name_case Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character)
cas_match_labels 1 consensus_match group_key=testosterone||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'58-22-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35e94c805d398df4: {'58-22-0': 'exactMatch'}
concept_associations 1 carry_associations_onto_flows associations resolved on the elementary layer
context 1 default_context_mapping Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water
context_iri 1 default_context_mapping Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water
name 1 bootstrap_labels Purged legacy name field to enforce prefLabel usage
references 1 enrich_references Added references with provenance; cas_numbers=['58-22-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_17347']; candidate_pubchem_cids=[5408, 6013, 92456, 5701998, 6432567, 11870497, 12304592, 12304601, 19615208, 49849358, 87229213, 169544695]; selected_pubchem_cids=[6013]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes
skos_definition 1 enrich_references Merged ChEBI/PubChem definitions into skos:definition
synonyms 1 bootstrap_labels Removed legacy synonyms field in favor of structured labels
types 1 link_flows_to_their_substance the substance's answer, copied onto its flow
unit_iri 1 unit_normalization Unit IRI set from normalization of 'kg'

Where several steps wrote one field, the last one won — and the log below shows the sequence.

Changes

21
# Step Field From To Why
12,520 bootstrap_labels prefLabel — [{"@value":"testosterone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"b… Bootstrapped prefLabel from legacy name field
12,521 bootstrap_labels name testosterone — Purged legacy name field to enforce prefLabel usage
12,522 bootstrap_labels synonyms ["(17beta)-17-Hydroxyandrost-4-en-3-one","(8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,… [] Removed legacy synonyms field in favor of structured labels
113,455 default_context_mapping context — {"dimension":"Environmental","media":"Water","water_body":"Surface water"} Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water
113,456 default_context_mapping context_iri — https://vocab.brightway.one/flow-contexts/envi-wate-suwa Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water
217,485 unit_normalization unit_iri — https://vocab.brightway.one/units/unit/KiloGM Unit IRI set from normalization of 'kg'
223,998 normalize_name_case prefLabel [{"@value":"testosterone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"b… [{"@value":"Testosterone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"b… Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character)
239,077 enrich_references properties {} {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1)
239,078 enrich_references skos_definition — [{"@value":"An androstanoid having 17β-hydroxy and 3-oxo groups, together with unsaturation at C-4‒C-5..","@language":"… Merged ChEBI/PubChem definitions into skos:definition
239,079 enrich_references references [] [{"@id":"beilstein:3653705","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… Added references with provenance; cas_numbers=['58-22-0']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_17347']; candidate_pubchem_cids=[5408, 6013, 92456, 5701998, 6432567, 11870497, 12304592, 12304601, 19615208, 49849358, 87229213, 169544695]; selected_pubchem_cids=[6013]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes
251,742 rdkit_pre_consensus properties {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… rdkit_pre_consensus from 'CC12CCC3C(C1CCC2O)CCC4=CC(=O)CCC34C'; added: inchi2d_string
256,109 chebi_altlabels altLabel [] [{"@value":"17beta-Hydroxy-4-androsten-3-one","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:… Added 8 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s)
272,348 consensus_match altLabel [{"@value":"17beta-Hydroxy-4-androsten-3-one","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:… [{"@value":"17beta-Hydroxy-4-androsten-3-one","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:… group_key=testosterone||dimension=Environmental > media=Water > water_body=Unknown; cas=58-22-0; added Common Chemistry CAS names as altLabel: (+)-Testosterone, (17β)-17-Hydroxyandrost-4-en-3-one, (8R,9S,10R,13S,14S,17S)-17-Hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1<em>H</em>-cyclopenta[<em>a</em>]phenanthren-3(2<em>H</em>)-one, 17β-Hydroxy-Δ<sup>4</sup>-androsten-3-one, 17β-Hydroxyandrost-4-en-3-one, 17β-Hydroxyandrost-4-ene-3-one, 17β-Testosterone, 4-Androsten-3-one-17β-ol, AA 2500, Andro 100, AndroForte 5, AndroGel, Androlin, Andronaq, Andropatch, Androst-4-en-17β-ol-3-one, Androst-4-en-3-one, 17-hydroxy-, (17β)-, Androst-4-ene-17β-ol-3-one, Andrusol, Axiron, CDB 111C, COL 1621, CP 601B, Compleo, Cristerona T, Geno-cristaux Gremy, Glowmin, Homosteron, Homosterone, Intrinsa, LPCN 1144, Livensa, MeSH ID: D013739, Mertestate, NSC 9700, Nasobol, Natesto, Neotestis, Noseafix, Opterone, Oreton, Orquisteron, Perandren, Percutacrine androgenique, Primotest, Primoteston, Relibra, Striant, Synandrol F, Teslen, Testandrone, Testiculosterone, Testim, Testobase, Testoderm, Testogel, Testolent, Testolin, Testopatch, Testopel, Testopropon, Testosteroid, Testoviron Schering, Testoviron T, Testro AQ, Testrone, Testryl, Tostrelle, Tostrex, Viatrel, Virormone, Virosterone, Δ<sup>4</sup>-Androsten-17β-ol-3-one; object_uuid=fo-35e94c805d398df4
272,349 consensus_match cas_match_labels — {"58-22-0":"exactMatch"} group_key=testosterone||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'58-22-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35e94c805d398df4: {'58-22-0': 'exactMatch'}
276,930 opsin_iupac properties {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '17beta-Hydroxy-4-androsten-3-one'
283,578 rdkit_post_consensus properties {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… rdkit_post_consensus from 'C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass
289,851 strip_catalogue_altlabels altLabel [{"@value":"17beta-Hydroxy-4-androsten-3-one","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:… [{"@value":"17beta-Hydroxy-4-androsten-3-one","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:… Removed 7 catalogue altLabel value(s): 'AA 2500' (grade code), 'Andro 100' (trade name), 'CDB 111C' (grade code), 'COL 1621' (grade code), 'CP 601B' (grade code), 'LPCN 1144' (grade code), 'NSC 9700' (registry code)
337,763 carry_associations_onto_flows concept_associations [] [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6aecf536-b952-… associations resolved on the elementary layer
391,311 normalise_property_values properties {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… typed the way the ontology types it
399,274 link_flows_to_their_substance types — ["https://w3id.org/chemrof/NeutralMolecule"] the substance's answer, copied onto its flow
399,275 link_flows_to_their_substance properties {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C19H28O2"]… the substance's answer, copied onto its flow

PROV-O trail

21 activities

One activity per change: which version of the flow it consumed, and which it produced. The values are on the change with the same number — stored once, not twice.

Activity Field Agent Used Generated
ef:activity/change/20261019T0712047113160000/12520 prefLabel ef:agent/bootstrap_labels ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v0 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v1
ef:activity/change/20261019T0712047113160000/12521 name ef:agent/bootstrap_labels ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v1 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v2
ef:activity/change/20261019T0712047113160000/12522 synonyms ef:agent/bootstrap_labels ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v2 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v3
ef:activity/change/20261019T0712047113160000/113455 context ef:agent/default_context_mapping ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v3 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v4
ef:activity/change/20261019T0712047113160000/113456 context_iri ef:agent/default_context_mapping ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v4 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v5
ef:activity/change/20261019T0712047113160000/217485 unit_iri ef:agent/unit_normalization ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v5 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v6
ef:activity/change/20261019T0712047113160000/223998 prefLabel ef:agent/normalize_name_case ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v6 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v7
ef:activity/change/20261019T0712047113160000/239077 properties ef:agent/enrich_references ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v7 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v8
ef:activity/change/20261019T0712047113160000/239078 skos_definition ef:agent/enrich_references ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v8 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v9
ef:activity/change/20261019T0712047113160000/239079 references ef:agent/enrich_references ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v9 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v10
ef:activity/change/20261019T0712047113160000/251742 properties ef:agent/rdkit_pre_consensus ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v10 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v11
ef:activity/change/20261019T0712047113160000/256109 altLabel ef:agent/chebi_altlabels ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v11 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v12
ef:activity/change/20261019T0712047113160000/272348 altLabel ef:agent/consensus_match ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v12 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v13
ef:activity/change/20261019T0712047113160000/272349 cas_match_labels ef:agent/consensus_match ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v13 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v14
ef:activity/change/20261019T0712047113160000/276930 properties ef:agent/opsin_iupac ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v14 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v15
ef:activity/change/20261019T0712047113160000/283578 properties ef:agent/rdkit_post_consensus ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v15 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v16
ef:activity/change/20261019T0712047113160000/289851 altLabel ef:agent/strip_catalogue_altlabels ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v16 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v17
ef:activity/change/20261019T0712047113160000/337763 concept_associations ef:agent/carry_associations_onto_flows ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v17 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v18
ef:activity/change/20261019T0712047113160000/391311 properties ef:agent/normalise_property_values ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v18 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v19
ef:activity/change/20261019T0712047113160000/399274 types ef:agent/link_flows_to_their_substance ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v19 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v20
ef:activity/change/20261019T0712047113160000/399275 properties ef:agent/link_flows_to_their_substance ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v20 ef:flow/6aecf536-b952-4ea6-bd29-b3fed1d1b8fd/v21

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