Reaction Mass Of (3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dione And (3ar,5s,7as)-5-methylhexahydro-2-benzofuran-1,3-dione And (3as,5r,7ar)-5-methylhexahydro-2-benzofuran-1,3-dione And (3as,5s,7ar)-5-methylhexahydro-2-benzofuran-1,3-dione
Everything that changed this flow. Back to the flow
ff100083-357a-47f4-8f32-5f73e78cf126
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 3 catalogue altLabel value(s): 'HN 7000' (grade code), 'NSC 128883' (registry code), 'WH 700' (grade code) |
| 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(3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3ar,5s,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5r,7ar)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5s,7ar)-5-methylhexahydro-2-benzofuran-1,3-dione||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'19438-60-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d54790229f0b22e3: {'19438-60-9': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['19438-60-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[86876, 3016472, 22445707, 59722415, 122130050]; selected_pubchem_cids=[86876]; 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 |
|---|---|---|---|---|---|
| 14,814 | bootstrap_labels | prefLabel | — | [{"@value":"reaction mass of (3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dione and (3ar,5s,7as)-5-methylhexahydro-2… | Bootstrapped prefLabel from legacy name field |
| 14,815 | bootstrap_labels | name | reaction mass of (3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dione and (3ar,5s,7as)-5-methylhexahydro-2-benzofuran-… | — | Purged legacy name field to enforce prefLabel usage |
| 14,816 | bootstrap_labels | synonyms | ["organic","hexahydro-4-methylphthalicanhydride","4-methylhexahydrophthalicanhydride","4-mhhpa"] | [] | Removed legacy synonyms field in favor of structured labels |
| 212,766 | 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 |
| 212,767 | 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 |
| 218,223 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,509 | normalize_name_case | prefLabel | [{"@value":"reaction mass of (3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dione and (3ar,5s,7as)-5-methylhexahydro-2… | [{"@value":"Reaction Mass Of (3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dione And (3ar,5s,7as)-5-methylhexahydro-2… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,194 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,195 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,196 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J147.413H","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['19438-60-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[86876, 3016472, 22445707, 59722415, 122130050]; selected_pubchem_cids=[86876]; 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 |
| 252,352 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | rdkit_pre_consensus from 'CC1CCC2C(C1)C(=O)OC2=O'; added: molecular_mass, monoisotopic_mass |
| 271,303 | consensus_match | altLabel | [] | [{"@value":"1,2-Cyclohexanedicarboxylic anhydride, 4-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=reactionmassof(3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3ar,5s,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5r,7ar)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5s,7ar)-5-methylhexahydro-2-benzofuran-1,3-dione||dimension=Environmental > media=Ground > geography=Unknown; cas=19438-60-9; added Common Chemistry CAS names as altLabel: 1,2-Cyclohexanedicarboxylic anhydride, 4-methyl-, 1,3-Isobenzofurandione, hexahydro-5-methyl-, 1-Methylcyclohexane-4,5-Dicarboxylic anhydride, 4-Methyl-1,2-cyclohexanedicarboxylic anhydride, 4-Methylhexahydrophthalic acid anhydride, 4-Methylhexahydrophthalic anhydride, EDK-X 52, HN 7000, Hexahydro-4-methylphthalic anhydride, Hexahydro-5-methyl-1,3-isobenzofurandione, Lindride 52, Lindride 52D, NSC 128883, Quinhard HH 400, Rikacid MH, Rikacid MH-T, WH 700; object_uuid=fo-d54790229f0b22e3 |
| 271,304 | consensus_match | cas_match_labels | — | {"19438-60-9":"exactMatch"} | group_key=reactionmassof(3ar,5r,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3ar,5s,7as)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5r,7ar)-5-methylhexahydro-2-benzofuran-1,3-dioneand(3as,5s,7ar)-5-methylhexahydro-2-benzofuran-1,3-dione||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'19438-60-9': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d54790229f0b22e3: {'19438-60-9': 'exactMatch'} |
| 277,545 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,2-Cyclohexanedicarboxylic anhydride, 4-methyl-' |
| 284,241 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | rdkit_post_consensus from 'CC1CCC2C(=O)OC(=O)C2C1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,290 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2-Cyclohexanedicarboxylic anhydride, 4-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consens… | [{"@value":"1,2-Cyclohexanedicarboxylic anhydride, 4-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consens… | Removed 3 catalogue altLabel value(s): 'HN 7000' (grade code), 'NSC 128883' (registry code), 'WH 700' (grade code) |
| 387,426 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/ff100083-357a-… | associations resolved on the elementary layer |
| 391,904 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12O3"],… | typed the way the ontology types it |
| 400,139 | 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/20260821T1554374006150000/14814 | prefLabel | ef:agent/bootstrap_labels | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v0 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v1 |
| ef:activity/change/20260821T1554374006150000/14815 | name | ef:agent/bootstrap_labels | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v1 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v2 |
| ef:activity/change/20260821T1554374006150000/14816 | synonyms | ef:agent/bootstrap_labels | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v2 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v3 |
| ef:activity/change/20260821T1554374006150000/212766 | context | ef:agent/default_context_mapping | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v3 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v4 |
| ef:activity/change/20260821T1554374006150000/212767 | context_iri | ef:agent/default_context_mapping | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v4 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v5 |
| ef:activity/change/20260821T1554374006150000/218223 | unit_iri | ef:agent/unit_normalization | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v5 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v6 |
| ef:activity/change/20260821T1554374006150000/224509 | prefLabel | ef:agent/normalize_name_case | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v6 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v7 |
| ef:activity/change/20260821T1554374006150000/241194 | properties | ef:agent/enrich_references | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v7 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v8 |
| ef:activity/change/20260821T1554374006150000/241195 | skos_definition | ef:agent/enrich_references | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v8 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v9 |
| ef:activity/change/20260821T1554374006150000/241196 | references | ef:agent/enrich_references | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v9 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v10 |
| ef:activity/change/20260821T1554374006150000/252352 | properties | ef:agent/rdkit_pre_consensus | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v10 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v11 |
| ef:activity/change/20260821T1554374006150000/271303 | altLabel | ef:agent/consensus_match | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v11 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v12 |
| ef:activity/change/20260821T1554374006150000/271304 | cas_match_labels | ef:agent/consensus_match | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v12 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v13 |
| ef:activity/change/20260821T1554374006150000/277545 | properties | ef:agent/opsin_iupac | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v13 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v14 |
| ef:activity/change/20260821T1554374006150000/284241 | properties | ef:agent/rdkit_post_consensus | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v14 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v15 |
| ef:activity/change/20260821T1554374006150000/290290 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v15 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v16 |
| ef:activity/change/20260821T1554374006150000/387426 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v16 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v17 |
| ef:activity/change/20260821T1554374006150000/391904 | properties | ef:agent/normalise_property_values | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v17 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v18 |
| ef:activity/change/20260821T1554374006150000/400139 | types | ef:agent/link_flows_to_their_substance | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v18 | ef:flow/ff100083-357a-47f4-8f32-5f73e78cf126/v19 |