Reaction Mass Of (2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one And (2z)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one
Everything that changed this flow. Back to the flow
b9c5dd3e-d278-4f5c-ae7f-fa5a39811714
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=reactionmassof(2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-oneand(2z)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'924626-15-3': []}; assigned CAS labels from group consensus; object_uuid=fo-6fbbd8738a7709f9: {'924626-15-3': '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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['924626-15-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[66647880]; selected_pubchem_cids=[66647880]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 22,275 | bootstrap_labels | prefLabel | — | [{"@value":"reaction mass of (2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one and (2z)-2-benylidene-5,6-dimethox… | Bootstrapped prefLabel from legacy name field |
| 22,276 | bootstrap_labels | name | reaction mass of (2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one and (2z)-2-benylidene-5,6-dimethoxy-3,3-dimeth… | — | Purged legacy name field to enforce prefLabel usage |
| 22,277 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 160,012 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 160,013 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 220,426 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 226,112 | normalize_name_case | prefLabel | [{"@value":"reaction mass of (2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one and (2z)-2-benylidene-5,6-dimethox… | [{"@value":"Reaction Mass Of (2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one And (2z)-2-benylidene-5,6-dimethox… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 247,348 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 247,349 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 247,350 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.117.419","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['924626-15-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[66647880]; selected_pubchem_cids=[66647880]; 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 |
| 254,136 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | rdkit_pre_consensus from 'CC1(C2=CC(=C(C=C2C(=O)C1=CC3=CC=CC=C3)OC)OC)C'; added: molecular_mass, monoisotopic_mass |
| 271,301 | consensus_match | altLabel | [] | [{"@value":"1<em>H</em>-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-","@language":"en","sou… | group_key=reactionmassof(2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-oneand(2z)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one||dimension=Environmental > media=Water > water_body=Long-term; cas=924626-15-3; added Common Chemistry CAS names as altLabel: 1<em>H</em>-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-, 2,3-Dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-1<em>H</em>-inden-1-one, 2-Benzylidene-3,3-dimethyl-5,6-dimethoxy-1-indanone, SymHelios 1031, Symurban; object_uuid=fo-6fbbd8738a7709f9 |
| 271,302 | consensus_match | cas_match_labels | — | {"924626-15-3":"exactMatch"} | group_key=reactionmassof(2e)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-oneand(2z)-2-benylidene-5,6-dimethoxy-3,3-dimethylindan-1-one||dimension=Environmental > media=Water > water_body=Long-term; group_sources=[]; cas_sources={'924626-15-3': []}; assigned CAS labels from group consensus; object_uuid=fo-6fbbd8738a7709f9: {'924626-15-3': 'exactMatch'} |
| 279,336 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-' |
| 286,211 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | rdkit_post_consensus from 'COc1cc2c(cc1OC)C(C)(C)C(=Cc1ccccc1)C2=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,169 | dedupe_altlabels | altLabel | [{"@value":"1<em>H</em>-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-","@language":"en","sou… | [{"@value":"1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-3,3-dimethyl-2-(phenylmethylene)-","@language":"en","source":{"pr… | Deduplicated altLabel values and removed entries matching prefLabel |
| 361,030 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b9c5dd3e-d278-… | associations resolved on the elementary layer |
| 393,729 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C20H20O3"]… | typed the way the ontology types it |
| 402,883 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260821T1554374006150000/22275 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v0 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v1 |
| ef:activity/change/20260821T1554374006150000/22276 | name | ef:agent/bootstrap_labels | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v1 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v2 |
| ef:activity/change/20260821T1554374006150000/22277 | synonyms | ef:agent/bootstrap_labels | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v2 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v3 |
| ef:activity/change/20260821T1554374006150000/160012 | context | ef:agent/default_context_mapping | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v3 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v4 |
| ef:activity/change/20260821T1554374006150000/160013 | context_iri | ef:agent/default_context_mapping | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v4 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v5 |
| ef:activity/change/20260821T1554374006150000/220426 | unit_iri | ef:agent/unit_normalization | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v5 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v6 |
| ef:activity/change/20260821T1554374006150000/226112 | prefLabel | ef:agent/normalize_name_case | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v6 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v7 |
| ef:activity/change/20260821T1554374006150000/247348 | properties | ef:agent/enrich_references | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v7 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v8 |
| ef:activity/change/20260821T1554374006150000/247349 | skos_definition | ef:agent/enrich_references | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v8 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v9 |
| ef:activity/change/20260821T1554374006150000/247350 | references | ef:agent/enrich_references | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v9 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v10 |
| ef:activity/change/20260821T1554374006150000/254136 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v10 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v11 |
| ef:activity/change/20260821T1554374006150000/271301 | altLabel | ef:agent/consensus_match | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v11 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v12 |
| ef:activity/change/20260821T1554374006150000/271302 | cas_match_labels | ef:agent/consensus_match | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v12 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v13 |
| ef:activity/change/20260821T1554374006150000/279336 | properties | ef:agent/opsin_iupac | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v13 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v14 |
| ef:activity/change/20260821T1554374006150000/286211 | properties | ef:agent/rdkit_post_consensus | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v14 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v15 |
| ef:activity/change/20260821T1554374006150000/293169 | altLabel | ef:agent/dedupe_altlabels | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v15 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v16 |
| ef:activity/change/20260821T1554374006150000/361030 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v16 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v17 |
| ef:activity/change/20260821T1554374006150000/393729 | properties | ef:agent/normalise_property_values | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v17 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v18 |
| ef:activity/change/20260821T1554374006150000/402883 | types | ef:agent/link_flows_to_their_substance | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v18 | ef:flow/b9c5dd3e-d278-4f5c-ae7f-fa5a39811714/v19 |