Grotan
Everything that changed this flow. Back to the flow
08a91e70-3ddc-11dd-a171-0050c2490048
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 10 catalogue altLabel value(s): 'Bestcide 1087T' (trade name), 'Busan 1060' (trade name), 'Busan 1506' (trade name), 'ETA 75' (grade code), 'KM 200' (grade code), 'KM 200 (alcohol)' (grade code), 'Mergal 165' (trade name), 'NSC 516387' (registry code), 'Onyxide 200' (trade name), 'Triadine 174' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=grotan||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4719-04-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d52365360af8397: {'4719-04-4': '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 air > Emissions to air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 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=['4719-04-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[78178, 104556]; selected_pubchem_cids=[104556]; 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 |
|---|---|---|---|---|---|
| 8,992 | bootstrap_labels | prefLabel | — | [{"@value":"Grotan","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"consens… | Bootstrapped prefLabel from legacy name field |
| 8,993 | bootstrap_labels | name | Grotan | — | Purged legacy name field to enforce prefLabel usage |
| 8,994 | bootstrap_labels | synonyms | ["1,3,5-TRIAZINE-1,3,5(2H,4H, 6H)-TRIETHANOL","2-[4,6-bis(2-hydroxyethyl)-1,3,5-triazinan-2-yl]ethanol","AC1L2H3I"] | [] | Removed legacy synonyms field in favor of structured labels |
| 40,788 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 40,789 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 216,331 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 235,785 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 235,786 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 235,787 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.219E","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['4719-04-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[78178, 104556]; selected_pubchem_cids=[104556]; 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 |
| 250,788 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | rdkit_pre_consensus from 'C1N(CN(CN1CCO)CCO)CCO'; added: molecular_mass, monoisotopic_mass |
| 267,469 | consensus_match | altLabel | [] | [{"@value":"1,3,5-Triazine-1,3,5(2<em>H</em>,4<em>H</em>,6<em>H</em>)-triethanol","@language":"en","source":{"prov:wasG… | group_key=grotan||dimension=Environmental > media=Air > strata=Unknown; cas=4719-04-4; added Common Chemistry CAS names as altLabel: 1,3,5-Triazine-1,3,5(2<em>H</em>,4<em>H</em>,6<em>H</em>)-triethanol, 1,3,5-Tris(2-hydroxyethyl)-1,3,5-triazacyclohexane, 1,3,5-Tris(2-hydroxyethyl)hexahydro-1,3,5-triazine, 1,3,5-Tris(2-hydroxyethyl)hexahydro-<em>s</em>-triazine, 1,3,5-Tris(hydroxyethyl)-<em>S</em>-triazine, 2,2′,2′′-(Hexahydro-1,3,5-triazine-1,3,5-triyl)triethanol, 2-[3,5-Bis(2-hydroxyethyl)-1,3,5-triazinan-1-yl]ethanol, <em>N</em>,<em>N</em>′,<em>N</em>′′-Tris(2-hydroxyethyl)hexahydro-<em>s</em>-triazine, <em>N</em>,<em>N</em>′,<em>N</em>′′-Tris(β-hydroxyethyl)hexahydro-<em>s</em>-triazine, <em>s</em>-Triazine-1,3,5(2<em>H</em>,4<em>H</em>,6<em>H</em>)-triethanol, Actane, Acticide GR, Amebact C, BK, Bactraclean, Bestcide 1087T, Bioban GK, Biocide BK, Busan 1060, Busan 1506, Cobate C, Dodigen NJ, ETA 75, Grotan B, Grotan BK, Hexahydro-1,3,5-tri(2-hydroxyethyl)-<em>s</em>-triazine, Hexahydro-1,3,5-tris(2-hydroxyethyl)-<em>s</em>-triazine, Hexahydro-1,3,5-tris(hydroxyethyl)-<em>s</em>-triazine, Hydroxyethyl hexahydrotriazine, KM 200, KM 200 (alcohol), Kalpur TE, Mergal 165, NSC 516387, Nipacide BK, Onyxide 200, Permachem OB 2, Polibaccid, Protectol HT, Roksol T 1-7, Surcide D, Surcide P, Triadine 174, Triadine 3; object_uuid=fo-7d52365360af8397 |
| 267,470 | consensus_match | cas_match_labels | — | {"4719-04-4":"exactMatch"} | group_key=grotan||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4719-04-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d52365360af8397: {'4719-04-4': 'exactMatch'} |
| 275,970 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanol' |
| 282,539 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | rdkit_post_consensus from 'OCCN1CN(CCO)CN(CCO)C1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,137 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3,5-Triazine-1,3,5(2<em>H</em>,4<em>H</em>,6<em>H</em>)-triethanol","@language":"en","source":{"prov:wasG… | [{"@value":"1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | Removed 10 catalogue altLabel value(s): 'Bestcide 1087T' (trade name), 'Busan 1060' (trade name), 'Busan 1506' (trade name), 'ETA 75' (grade code), 'KM 200' (grade code), 'KM 200 (alcohol)' (grade code), 'Mergal 165' (trade name), 'NSC 516387' (registry code), 'Onyxide 200' (trade name), 'Triadine 174' (trade name) |
| 301,419 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 390,318 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H21N3O3"… | typed the way the ontology types it |
| 397,880 | 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/20260822T0600486828500000/8992 | prefLabel | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v0 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v1 |
| ef:activity/change/20260822T0600486828500000/8993 | name | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v1 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v2 |
| ef:activity/change/20260822T0600486828500000/8994 | synonyms | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v2 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v3 |
| ef:activity/change/20260822T0600486828500000/40788 | context | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v3 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v4 |
| ef:activity/change/20260822T0600486828500000/40789 | context_iri | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v4 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v5 |
| ef:activity/change/20260822T0600486828500000/216331 | unit_iri | ef:agent/unit_normalization | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v5 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v6 |
| ef:activity/change/20260822T0600486828500000/235785 | properties | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v6 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v7 |
| ef:activity/change/20260822T0600486828500000/235786 | skos_definition | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v7 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v8 |
| ef:activity/change/20260822T0600486828500000/235787 | references | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v8 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v9 |
| ef:activity/change/20260822T0600486828500000/250788 | properties | ef:agent/rdkit_pre_consensus | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v9 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v10 |
| ef:activity/change/20260822T0600486828500000/267469 | altLabel | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v10 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v11 |
| ef:activity/change/20260822T0600486828500000/267470 | cas_match_labels | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v11 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v12 |
| ef:activity/change/20260822T0600486828500000/275970 | properties | ef:agent/opsin_iupac | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v12 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v13 |
| ef:activity/change/20260822T0600486828500000/282539 | properties | ef:agent/rdkit_post_consensus | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v13 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v14 |
| ef:activity/change/20260822T0600486828500000/289137 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v14 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v15 |
| ef:activity/change/20260822T0600486828500000/301419 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v15 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v16 |
| ef:activity/change/20260822T0600486828500000/390318 | properties | ef:agent/normalise_property_values | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v16 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v17 |
| ef:activity/change/20260822T0600486828500000/397880 | types | ef:agent/link_flows_to_their_substance | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v17 | ef:flow/08a91e70-3ddc-11dd-a171-0050c2490048/v18 |