2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone
Everything that changed this flow. Back to the flow
717d42cf-b3de-4cb9-82f1-00930e73ca3a
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 2 catalogue altLabel value(s): 'C.I. 71132' (registry code), 'Paliogen 0084' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory']; cas_sources={'67075-37-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-ddcb9211f7dc6f25: {'67075-37-0': '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 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=['67075-37-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[105396, 168492, 45358583]; selected_pubchem_cids=[105396]; 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 |
|---|---|---|---|---|---|
| 17,926 | bootstrap_labels | prefLabel | — | [{"@value":"2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone","@lan… | Bootstrapped prefLabel from legacy name field |
| 17,927 | bootstrap_labels | name | 2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone | — | Purged legacy name field to enforce prefLabel usage |
| 17,928 | bootstrap_labels | synonyms | ["organic","2,9-bis(2-phenylethyl)anthra[2,1,9-def:6,5,10-d'","e'","f'","]diisoquinoline-1,3,8,10(2h,9h)-te… | [] | Removed legacy synonyms field in favor of structured labels |
| 117,336 | 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 |
| 117,337 | 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 |
| 219,209 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 243,971 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,972 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,973 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J213.083A","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['67075-37-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[105396, 168492, 45358583]; selected_pubchem_cids=[105396]; 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 |
| 253,155 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | rdkit_pre_consensus from 'C1=CC=C(C=C1)CCN2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)CCC9=CC=CC=C9)C2=O'; added: molecular_mass, monoisotopic_mass |
| 260,164 | consensus_match | altLabel | [] | [{"@value":"2,9-Bis(2-phenylethyl)anthra[2,1,9-<em>def</em>:6,5,10-<em>d</em>'<em>e</em>'<em>f</em>′]diisoquinoline-1,3… | group_key=2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone||dimension=Environmental > media=Water > water_body=Ocean; cas=67075-37-0; added Common Chemistry CAS names as altLabel: 2,9-Bis(2-phenylethyl)anthra[2,1,9-<em>def</em>:6,5,10-<em>d</em>'<em>e</em>'<em>f</em>′]diisoquinoline-1,3,8,10(2<em>H</em>,9<em>H</em>)-tetrone, 2,9-Diphenethylanthra[2,1,9-<em>def</em>:6,5,10-<em>d</em>'<em>e</em>'<em>f</em>′]diisoquinoline-1,3,8,10(2<em>H</em>,9<em>H</em>)-tetraone, <em>N</em>,<em>N</em>′-Bis(2-phenethyl)perylene-3,4:9,10-bis(dicarboximide), <em>N</em>,<em>N</em>′-Bis(2-phenylethyl)-3,4:9,10-perylenetetracarboxylic diimide, <em>N</em>,<em>N</em>′-Bis(2-phenylethyl)perylene-3,4,9,10-dicarboximide, <em>N</em>,<em>N</em>′-Bis(2-phenylethyl)perylene-3,4:9,10-bis(dicarboximide), <em>N</em>,<em>N</em>′-Bis-(2-phenylethyl)pyrene-3,4,9,10-dicarbodiimide, <em>N</em>,<em>N</em>′-Diphenethyl-3,4,9,10-perylenetetracarboxylic diimide, Anthra[2,1,9-<em>def</em>:6,5,10-<em>d</em>'<em>e</em>'<em>f</em>′]diisoquinoline-1,3,8,10(2<em>H</em>,9<em>H</em>)-tetrone, 2,9-bis(2-phenylethyl)-, Black S 0084, C.I. 71132, C.I. Pigment Black 31, PEPTC, PPEI, Paliogen 0084, Paliogen Black L 0084, Paliogen Black S 0084, Paliogen S 0084, Pallogen Black S 0084, Perylene-3,4:9,10-tetracarboxylic acid bis(β-phenylethylimide), Pigment Black 31, Spectrasense Black S 0084; object_uuid=fo-ddcb9211f7dc6f25 |
| 260,165 | consensus_match | cas_match_labels | — | {"67075-37-0":"exactMatch"} | group_key=2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory']; cas_sources={'67075-37-0': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-ddcb9211f7dc6f25: {'67075-37-0': 'exactMatch'} |
| 278,360 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,9-bis(2-phenylethyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2h,9h)-tetrone' |
| 285,117 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | rdkit_post_consensus from 'O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1CCc1ccccc1)c64)C(=O)N(CCc1ccccc1)C5=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,869 | strip_catalogue_altlabels | altLabel | [{"@value":"2,9-Bis(2-phenylethyl)anthra[2,1,9-<em>def</em>:6,5,10-<em>d</em>'<em>e</em>'<em>f</em>′]diisoquinoline-1,3… | [{"@value":"2,9-Bis(2-phenylethyl)anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone","@language":"e… | Removed 2 catalogue altLabel value(s): 'C.I. 71132' (registry code), 'Paliogen 0084' (trade name) |
| 339,666 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/717d42cf-b3de-… | associations resolved on the elementary layer |
| 392,724 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H26N2O4… | typed the way the ontology types it |
| 401,333 | 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/20260821T1554374006150000/17926 | prefLabel | ef:agent/bootstrap_labels | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v0 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v1 |
| ef:activity/change/20260821T1554374006150000/17927 | name | ef:agent/bootstrap_labels | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v1 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v2 |
| ef:activity/change/20260821T1554374006150000/17928 | synonyms | ef:agent/bootstrap_labels | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v2 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v3 |
| ef:activity/change/20260821T1554374006150000/117336 | context | ef:agent/default_context_mapping | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v3 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v4 |
| ef:activity/change/20260821T1554374006150000/117337 | context_iri | ef:agent/default_context_mapping | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v4 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v5 |
| ef:activity/change/20260821T1554374006150000/219209 | unit_iri | ef:agent/unit_normalization | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v5 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v6 |
| ef:activity/change/20260821T1554374006150000/243971 | properties | ef:agent/enrich_references | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v6 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v7 |
| ef:activity/change/20260821T1554374006150000/243972 | skos_definition | ef:agent/enrich_references | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v7 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v8 |
| ef:activity/change/20260821T1554374006150000/243973 | references | ef:agent/enrich_references | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v8 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v9 |
| ef:activity/change/20260821T1554374006150000/253155 | properties | ef:agent/rdkit_pre_consensus | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v9 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v10 |
| ef:activity/change/20260821T1554374006150000/260164 | altLabel | ef:agent/consensus_match | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v10 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v11 |
| ef:activity/change/20260821T1554374006150000/260165 | cas_match_labels | ef:agent/consensus_match | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v11 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v12 |
| ef:activity/change/20260821T1554374006150000/278360 | properties | ef:agent/opsin_iupac | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v12 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v13 |
| ef:activity/change/20260821T1554374006150000/285117 | properties | ef:agent/rdkit_post_consensus | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v13 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v14 |
| ef:activity/change/20260821T1554374006150000/290869 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v14 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v15 |
| ef:activity/change/20260821T1554374006150000/339666 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v15 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v16 |
| ef:activity/change/20260821T1554374006150000/392724 | properties | ef:agent/normalise_property_values | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v16 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v17 |
| ef:activity/change/20260821T1554374006150000/401333 | types | ef:agent/link_flows_to_their_substance | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v17 | ef:flow/717d42cf-b3de-4cb9-82f1-00930e73ca3a/v18 |