2,4,7,9-tetramethyldec-5-yne-4,7-diol
Everything that changed this flow. Back to the flow
35d16433-6a27-4b68-9209-03a381ec0de3
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 11 catalogue altLabel value(s): 'DF 104E' (grade code), 'NSC 5630' (registry code), 'PD 001' (grade code), 'PD 301' (grade code), 'Surfadol 541' (trade name), 'Surfynol 104' (trade name), 'Surfynol 104A' (trade name), 'Surfynol 104E' (trade name), 'Surfynol 104H' (trade name), 'Urfynol 104E' (trade name), 'Zetasperse 1200' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=2,4,7,9-tetramethyldec-5-yne-4,7-diol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'126-86-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6b142acfd09f3c3c: {'126-86-3': '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=['126-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[31362, 129318141]; selected_pubchem_cids=[31362]; 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 |
|---|---|---|---|---|---|
| 20,486 | bootstrap_labels | prefLabel | — | [{"@value":"2,4,7,9-tetramethyldec-5-yne-4,7-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels",… | Bootstrapped prefLabel from legacy name field |
| 20,487 | bootstrap_labels | name | 2,4,7,9-tetramethyldec-5-yne-4,7-diol | — | Purged legacy name field to enforce prefLabel usage |
| 20,488 | bootstrap_labels | synonyms | ["organic","2,4,7,9-tetramethyldec-5-yne-4,7-diol","1,4-diisobutyl-1,4-dimethylbutynediol","2,4,7,9-tetramethyl-5-decyn… | [] | Removed legacy synonyms field in favor of structured labels |
| 72,654 | 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 |
| 72,655 | 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 |
| 219,971 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 246,103 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,104 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,105 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.933E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['126-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[31362, 129318141]; selected_pubchem_cids=[31362]; 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 |
| 253,776 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | rdkit_pre_consensus from 'CC(C)CC(C)(C#CC(C)(CC(C)C)O)O'; added: molecular_mass, monoisotopic_mass |
| 259,900 | consensus_match | altLabel | [] | [{"@value":"1,4-Diisobutyl-1,4-dimethylbutynediol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | group_key=2,4,7,9-tetramethyldec-5-yne-4,7-diol||dimension=Environmental > media=Air > strata=Unknown; cas=126-86-3; added Common Chemistry CAS names as altLabel: 1,4-Diisobutyl-1,4-dimethylbutynediol, 104BC, 104E, 104H, 2,4,7,9-Tetramethyl-5-decyn-4,7-diol, 2,4,7,9-Tetramethyl-5-decyne-4,7-diol, 5-Decyne-4,7-diol, 2,4,7,9-tetramethyl-, Acetylenol E 00, DF 104E, GS 850PA, LA-W 1092, NSC 5630, Olfine AK 02, Olfine PD 001, Olfine PD 301, Olfine STG-E, PD 001, PD 301, Surfadol 541, Surfadol 541DPM, Surfynol 104, Surfynol 104A, Surfynol 104BC, Surfynol 104E, Surfynol 104H, Surfynol 104PA, Surfynol CT 111, Surfynol DF 104E, Surfynol PG 50, Surfynol TG, TMDD, TMDD-BG 52, TMDDO, Tuyile FS 204, Urfynol 104E, Zetasperse 1200; object_uuid=fo-6b142acfd09f3c3c |
| 259,901 | consensus_match | cas_match_labels | — | {"126-86-3":"exactMatch"} | group_key=2,4,7,9-tetramethyldec-5-yne-4,7-diol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'126-86-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6b142acfd09f3c3c: {'126-86-3': 'exactMatch'} |
| 278,976 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,4,7,9-tetramethyldec-5-yne-4,7-diol' |
| 285,795 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | rdkit_post_consensus from 'CC(C)CC(C)(O)C#CC(C)(O)CC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,325 | strip_catalogue_altlabels | altLabel | [{"@value":"1,4-Diisobutyl-1,4-dimethylbutynediol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | [{"@value":"1,4-Diisobutyl-1,4-dimethylbutynediol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | Removed 11 catalogue altLabel value(s): 'DF 104E' (grade code), 'NSC 5630' (registry code), 'PD 001' (grade code), 'PD 301' (grade code), 'Surfadol 541' (trade name), 'Surfynol 104' (trade name), 'Surfynol 104A' (trade name), 'Surfynol 104E' (trade name), 'Surfynol 104H' (trade name), 'Urfynol 104E' (trade name), 'Zetasperse 1200' (trade name) |
| 317,337 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/35d16433-6a27-… | associations resolved on the elementary layer |
| 393,351 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26O2"]… | typed the way the ontology types it |
| 402,272 | 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/20260821T0609040591070000/20486 | prefLabel | ef:agent/bootstrap_labels | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v0 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v1 |
| ef:activity/change/20260821T0609040591070000/20487 | name | ef:agent/bootstrap_labels | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v1 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v2 |
| ef:activity/change/20260821T0609040591070000/20488 | synonyms | ef:agent/bootstrap_labels | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v2 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v3 |
| ef:activity/change/20260821T0609040591070000/72654 | context | ef:agent/default_context_mapping | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v3 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v4 |
| ef:activity/change/20260821T0609040591070000/72655 | context_iri | ef:agent/default_context_mapping | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v4 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v5 |
| ef:activity/change/20260821T0609040591070000/219971 | unit_iri | ef:agent/unit_normalization | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v5 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v6 |
| ef:activity/change/20260821T0609040591070000/246103 | properties | ef:agent/enrich_references | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v6 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v7 |
| ef:activity/change/20260821T0609040591070000/246104 | skos_definition | ef:agent/enrich_references | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v7 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v8 |
| ef:activity/change/20260821T0609040591070000/246105 | references | ef:agent/enrich_references | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v8 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v9 |
| ef:activity/change/20260821T0609040591070000/253776 | properties | ef:agent/rdkit_pre_consensus | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v9 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v10 |
| ef:activity/change/20260821T0609040591070000/259900 | altLabel | ef:agent/consensus_match | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v10 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v11 |
| ef:activity/change/20260821T0609040591070000/259901 | cas_match_labels | ef:agent/consensus_match | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v11 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v12 |
| ef:activity/change/20260821T0609040591070000/278976 | properties | ef:agent/opsin_iupac | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v12 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v13 |
| ef:activity/change/20260821T0609040591070000/285795 | properties | ef:agent/rdkit_post_consensus | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v13 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v14 |
| ef:activity/change/20260821T0609040591070000/291325 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v14 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v15 |
| ef:activity/change/20260821T0609040591070000/317337 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v15 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v16 |
| ef:activity/change/20260821T0609040591070000/393351 | properties | ef:agent/normalise_property_values | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v16 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v17 |
| ef:activity/change/20260821T0609040591070000/402272 | types | ef:agent/link_flows_to_their_substance | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v17 | ef:flow/35d16433-6a27-4b68-9209-03a381ec0de3/v18 |