1,2,3,4-tetrahydroisoquinoline
Everything that changed this flow. Back to the flow
0bef4193-4bcc-40ba-97a8-23975e837c82
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 15312' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1,2,3,4-tetrahydroisoquinoline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'91-21-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a75c7ec83a1c1e4c: {'91-21-4': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['91-21-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[7046, 5311333, 7057981, 21303776, 131674211]; selected_pubchem_cids=[7046]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 10,801 | bootstrap_labels | prefLabel | — | [{"@value":"1,2,3,4-tetrahydroisoquinoline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 10,802 | bootstrap_labels | name | 1,2,3,4-tetrahydroisoquinoline | — | Purged legacy name field to enforce prefLabel usage |
| 10,803 | bootstrap_labels | synonyms | ["organic","1,2,3,4-tetrahydroisoquinoline"] | [] | Removed legacy synonyms field in favor of structured labels |
| 43,554 | 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 |
| 43,555 | 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 |
| 216,921 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 237,460 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,461 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,462 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.337K","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['91-21-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[7046, 5311333, 7057981, 21303776, 131674211]; selected_pubchem_cids=[7046]; 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 |
| 251,267 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | rdkit_pre_consensus from 'C1CNCC2=CC=CC=C21'; added: molecular_mass, monoisotopic_mass |
| 258,256 | consensus_match | altLabel | [] | [{"@value":"1,2,3,4-Tetrahydro-2-azanaphthalene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | group_key=1,2,3,4-tetrahydroisoquinoline||dimension=Environmental > media=Water > water_body=Surface water; cas=91-21-4; added Common Chemistry CAS names as altLabel: 1,2,3,4-Tetrahydro-2-azanaphthalene, 1,2,3,4-Tetrahydro-2-isoquinoline, 1,2,3,4-Tetrahydroisoquinline, 3,4-Dihydro-1<em>H</em>-isoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-, NSC 15312, Tetrahydroisoquinoline; object_uuid=fo-a75c7ec83a1c1e4c |
| 258,257 | consensus_match | cas_match_labels | — | {"91-21-4":"exactMatch"} | group_key=1,2,3,4-tetrahydroisoquinoline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'91-21-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a75c7ec83a1c1e4c: {'91-21-4': 'exactMatch'} |
| 276,449 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,2,3,4-tetrahydroisoquinoline' |
| 283,052 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | rdkit_post_consensus from 'c1ccc2c(c1)CCNC2'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,492 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2,3,4-Tetrahydro-2-azanaphthalene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | [{"@value":"1,2,3,4-Tetrahydro-2-azanaphthalene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | Removed 1 catalogue altLabel value(s): 'NSC 15312' (registry code) |
| 302,796 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0bef4193-4bcc-… | associations resolved on the elementary layer |
| 390,798 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H11N"],"… | typed the way the ontology types it |
| 398,574 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 activitiesOne 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/20260820T1812399309960000/10801 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v0 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v1 |
| ef:activity/change/20260820T1812399309960000/10802 | name | ef:agent/bootstrap_labels | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v1 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v2 |
| ef:activity/change/20260820T1812399309960000/10803 | synonyms | ef:agent/bootstrap_labels | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v2 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v3 |
| ef:activity/change/20260820T1812399309960000/43554 | context | ef:agent/default_context_mapping | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v3 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v4 |
| ef:activity/change/20260820T1812399309960000/43555 | context_iri | ef:agent/default_context_mapping | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v4 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v5 |
| ef:activity/change/20260820T1812399309960000/216921 | unit_iri | ef:agent/unit_normalization | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v5 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v6 |
| ef:activity/change/20260820T1812399309960000/237460 | properties | ef:agent/enrich_references | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v6 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v7 |
| ef:activity/change/20260820T1812399309960000/237461 | skos_definition | ef:agent/enrich_references | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v7 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v8 |
| ef:activity/change/20260820T1812399309960000/237462 | references | ef:agent/enrich_references | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v8 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v9 |
| ef:activity/change/20260820T1812399309960000/251267 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v9 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v10 |
| ef:activity/change/20260820T1812399309960000/258256 | altLabel | ef:agent/consensus_match | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v10 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v11 |
| ef:activity/change/20260820T1812399309960000/258257 | cas_match_labels | ef:agent/consensus_match | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v11 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v12 |
| ef:activity/change/20260820T1812399309960000/276449 | properties | ef:agent/opsin_iupac | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v12 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v13 |
| ef:activity/change/20260820T1812399309960000/283052 | properties | ef:agent/rdkit_post_consensus | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v13 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v14 |
| ef:activity/change/20260820T1812399309960000/289492 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v14 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v15 |
| ef:activity/change/20260820T1812399309960000/302796 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v15 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v16 |
| ef:activity/change/20260820T1812399309960000/390798 | properties | ef:agent/normalise_property_values | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v16 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v17 |
| ef:activity/change/20260820T1812399309960000/398574 | types | ef:agent/link_flows_to_their_substance | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v17 | ef:flow/0bef4193-4bcc-40ba-97a8-23975e837c82/v18 |