Methyl salicylate
Everything that changed this flow. Back to the flow
5e768e84-f919-4b53-ad4a-a6e46aaa9510
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 8204' (registry code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=119-36-8; cc_chebi_agreed_name='Methyl salicylate'; object_uuid=fo-851932128ef5cf8c |
| cas_match_labels | 1 | consensus_match | group_key=methyl2-hydroxybenzoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'119-36-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-851932128ef5cf8c: {'119-36-8': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['119-36-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_31832']; candidate_pubchem_cids=[4133]; selected_pubchem_cids=[4133]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,944 | bootstrap_labels | prefLabel | — | [{"@value":"methyl 2-hydroxybenzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 5,945 | bootstrap_labels | name | methyl 2-hydroxybenzoate | — | Purged legacy name field to enforce prefLabel usage |
| 5,946 | bootstrap_labels | synonyms | ["organic","methylsalicylate","2-hydroxybenzoatedemethyle","2-hydroxybenzoicacidmethylester","benzoicacid,2-hydroxy-,me… | [] | Removed legacy synonyms field in favor of structured labels |
| 105,794 | 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 |
| 105,795 | 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 |
| 215,325 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,467 | normalize_name_case | prefLabel | [{"@value":"methyl 2-hydroxybenzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Methyl 2-hydroxybenzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,897 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,898 | enrich_references | skos_definition | — | [{"@value":"A benzoate ester that is the methyl ester of salicylic acid.","@language":"en","provenance":{"prov:wasGener… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,899 | enrich_references | references | [] | [{"@id":"drugcentral:4245","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['119-36-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_31832']; candidate_pubchem_cids=[4133]; selected_pubchem_cids=[4133]; 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 |
| 249,963 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | rdkit_pre_consensus from 'COC(=O)C1=CC=CC=C1O'; added: monoisotopic_mass |
| 255,122 | chebi_altlabels | altLabel | [] | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Added 12 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 268,716 | consensus_match | prefLabel | [{"@value":"Methyl 2-hydroxybenzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Methyl salicylate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo… | cas=119-36-8; cc_chebi_agreed_name='Methyl salicylate'; object_uuid=fo-851932128ef5cf8c |
| 268,717 | consensus_match | altLabel | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | cas=119-36-8; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-851932128ef5cf8c |
| 268,718 | consensus_match | altLabel | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | group_key=methyl2-hydroxybenzoate||dimension=Environmental > media=Water > water_body=Long-term; cas=119-36-8; added Common Chemistry CAS names as altLabel: <em>o</em>-Hydroxybenzoic acid methyl ester, Analgit, Anthrapole ND, Ben Gay, Benzoic acid, 2-hydroxy-, methyl ester, Exagien, Flucarmit, Holly oil, Methyl ester 2-hydroxy benzoic acid, Methyl ester of 2-hydroxy benzoic acid, NSC 8204, PredaLure, Salicylic acid, methyl ester, Wintergreen oil; object_uuid=fo-851932128ef5cf8c |
| 268,719 | consensus_match | cas_match_labels | — | {"119-36-8":"exactMatch"} | group_key=methyl2-hydroxybenzoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'119-36-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-851932128ef5cf8c: {'119-36-8': 'exactMatch'} |
| 275,095 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Methyl salicylate' |
| 281,592 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | rdkit_post_consensus from 'COC(=O)c1ccccc1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,465 | strip_catalogue_altlabels | altLabel | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"2-(Methoxycarbonyl)phenol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Removed 1 catalogue altLabel value(s): 'NSC 8204' (registry code) |
| 333,895 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5e768e84-f919-… | associations resolved on the elementary layer |
| 389,404 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8O3"],"… | typed the way the ontology types it |
| 396,542 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260822T0600486828500000/5944 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v0 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v1 |
| ef:activity/change/20260822T0600486828500000/5945 | name | ef:agent/bootstrap_labels | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v1 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v2 |
| ef:activity/change/20260822T0600486828500000/5946 | synonyms | ef:agent/bootstrap_labels | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v2 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v3 |
| ef:activity/change/20260822T0600486828500000/105794 | context | ef:agent/default_context_mapping | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v3 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v4 |
| ef:activity/change/20260822T0600486828500000/105795 | context_iri | ef:agent/default_context_mapping | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v4 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v5 |
| ef:activity/change/20260822T0600486828500000/215325 | unit_iri | ef:agent/unit_normalization | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v5 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v6 |
| ef:activity/change/20260822T0600486828500000/222467 | prefLabel | ef:agent/normalize_name_case | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v6 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v7 |
| ef:activity/change/20260822T0600486828500000/232897 | properties | ef:agent/enrich_references | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v7 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v8 |
| ef:activity/change/20260822T0600486828500000/232898 | skos_definition | ef:agent/enrich_references | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v8 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v9 |
| ef:activity/change/20260822T0600486828500000/232899 | references | ef:agent/enrich_references | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v9 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v10 |
| ef:activity/change/20260822T0600486828500000/249963 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v10 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v11 |
| ef:activity/change/20260822T0600486828500000/255122 | altLabel | ef:agent/chebi_altlabels | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v11 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v12 |
| ef:activity/change/20260822T0600486828500000/268716 | prefLabel | ef:agent/consensus_match | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v12 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v13 |
| ef:activity/change/20260822T0600486828500000/268717 | altLabel | ef:agent/consensus_match | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v13 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v14 |
| ef:activity/change/20260822T0600486828500000/268718 | altLabel | ef:agent/consensus_match | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v14 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v15 |
| ef:activity/change/20260822T0600486828500000/268719 | cas_match_labels | ef:agent/consensus_match | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v15 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v16 |
| ef:activity/change/20260822T0600486828500000/275095 | properties | ef:agent/opsin_iupac | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v16 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v17 |
| ef:activity/change/20260822T0600486828500000/281592 | properties | ef:agent/rdkit_post_consensus | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v17 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v18 |
| ef:activity/change/20260822T0600486828500000/288465 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v18 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v19 |
| ef:activity/change/20260822T0600486828500000/333895 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v19 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v20 |
| ef:activity/change/20260822T0600486828500000/389404 | properties | ef:agent/normalise_property_values | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v20 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v21 |
| ef:activity/change/20260822T0600486828500000/396542 | types | ef:agent/link_flows_to_their_substance | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v21 | ef:flow/5e768e84-f919-4b53-ad4a-a6e46aaa9510/v22 |