1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione
Everything that changed this flow. Back to the flow
93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a
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 | 1 | consensus_match | group_key=1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione||dimension=Environmental > media=Air > strata=Unknown; cas=295800-70-3; added Common Chemistry CAS names as altLabel: 1,4-Bis[(2-ethylhexyl)amino]-5,8-dihydroxy-9,10-anthracenedione, 9,10-Anthracenedione, 1,4-bis[(2-ethylhexyl)amino]-5,8-dihydroxy-; object_uuid=fo-51bed389f6c575de |
| cas_match_labels | 1 | consensus_match | group_key=1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'295800-70-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-51bed389f6c575de: {'295800-70-3': '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 water, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, 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=['295800-70-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[23062166]; selected_pubchem_cids=[23062166]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 3,062 | bootstrap_labels | prefLabel | — | [{"@value":"1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione","@language":"en","source":{"prov:wasGenera… | Bootstrapped prefLabel from legacy name field |
| 3,063 | bootstrap_labels | name | 1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione | — | Purged legacy name field to enforce prefLabel usage |
| 3,064 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 137,748 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 137,749 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 214,361 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 230,120 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 230,121 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,122 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.235.509","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['295800-70-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[23062166]; selected_pubchem_cids=[23062166]; 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 |
| 249,166 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | rdkit_pre_consensus from 'CCCCC(CC)CNC1=C2C(=C(C=C1)NCC(CC)CCCC)C(=O)C3=C(C=CC(=C3C2=O)O)O'; added: molecular_mass, monoisotopic_mass |
| 258,642 | consensus_match | altLabel | [] | [{"@value":"1,4-Bis[(2-ethylhexyl)amino]-5,8-dihydroxy-9,10-anthracenedione","@language":"en","source":{"prov:wasGenera… | group_key=1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione||dimension=Environmental > media=Air > strata=Unknown; cas=295800-70-3; added Common Chemistry CAS names as altLabel: 1,4-Bis[(2-ethylhexyl)amino]-5,8-dihydroxy-9,10-anthracenedione, 9,10-Anthracenedione, 1,4-bis[(2-ethylhexyl)amino]-5,8-dihydroxy-; object_uuid=fo-51bed389f6c575de |
| 258,643 | consensus_match | cas_match_labels | — | {"295800-70-3":"exactMatch"} | group_key=1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'295800-70-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-51bed389f6c575de: {'295800-70-3': 'exactMatch'} |
| 274,280 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,4-bis((2-ethylhexyl)amino)-5,8-dihydroxyanthracene-9,10-dione' |
| 280,706 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | rdkit_post_consensus from 'CCCCC(CC)CNc1ccc(NCC(CC)CCCC)c2c1C(=O)c1c(O)ccc(O)c1C2=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 349,867 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/93fcabc4-ff68-… | associations resolved on the elementary layer |
| 388,570 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H42N2O4… | typed the way the ontology types it |
| 395,366 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260820T1812399309960000/3062 | prefLabel | ef:agent/bootstrap_labels | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v0 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v1 |
| ef:activity/change/20260820T1812399309960000/3063 | name | ef:agent/bootstrap_labels | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v1 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v2 |
| ef:activity/change/20260820T1812399309960000/3064 | synonyms | ef:agent/bootstrap_labels | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v2 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v3 |
| ef:activity/change/20260820T1812399309960000/137748 | context | ef:agent/default_context_mapping | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v3 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v4 |
| ef:activity/change/20260820T1812399309960000/137749 | context_iri | ef:agent/default_context_mapping | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v4 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v5 |
| ef:activity/change/20260820T1812399309960000/214361 | unit_iri | ef:agent/unit_normalization | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v5 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v6 |
| ef:activity/change/20260820T1812399309960000/230120 | properties | ef:agent/enrich_references | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v6 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v7 |
| ef:activity/change/20260820T1812399309960000/230121 | skos_definition | ef:agent/enrich_references | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v7 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v8 |
| ef:activity/change/20260820T1812399309960000/230122 | references | ef:agent/enrich_references | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v8 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v9 |
| ef:activity/change/20260820T1812399309960000/249166 | properties | ef:agent/rdkit_pre_consensus | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v9 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v10 |
| ef:activity/change/20260820T1812399309960000/258642 | altLabel | ef:agent/consensus_match | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v10 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v11 |
| ef:activity/change/20260820T1812399309960000/258643 | cas_match_labels | ef:agent/consensus_match | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v11 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v12 |
| ef:activity/change/20260820T1812399309960000/274280 | properties | ef:agent/opsin_iupac | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v12 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v13 |
| ef:activity/change/20260820T1812399309960000/280706 | properties | ef:agent/rdkit_post_consensus | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v13 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v14 |
| ef:activity/change/20260820T1812399309960000/349867 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v14 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v15 |
| ef:activity/change/20260820T1812399309960000/388570 | properties | ef:agent/normalise_property_values | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v15 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v16 |
| ef:activity/change/20260820T1812399309960000/395366 | types | ef:agent/link_flows_to_their_substance | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v16 | ef:flow/93fcabc4-ff68-4c0b-95c8-c0daa59c6f2a/v17 |