Trimethyl phosphate
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-9d3a-0050c2490048
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 58985' (registry code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=512-56-1; cc_chebi_agreed_name='Trimethyl phosphate'; object_uuid=fo-8d4f375970dc93ff |
| cas_match_labels | 1 | consensus_match | group_key=trimethylphosphate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'512-56-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8d4f375970dc93ff: {'512-56-1': '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=['512-56-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_46324']; candidate_pubchem_cids=[10541]; selected_pubchem_cids=[10541]; 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 |
|---|---|---|---|---|---|
| 11,603 | bootstrap_labels | prefLabel | — | [{"@value":"trimethylphosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 11,604 | bootstrap_labels | name | trimethylphosphate | — | Purged legacy name field to enforce prefLabel usage |
| 11,605 | bootstrap_labels | synonyms | ["AC1L1VF1","AC1Q6SF8","METHYL PHOSPHATE","Methyl phosphate, (MeO)3PO","NCI-C03781","O,O,O-Trimethyl phosphate","P0271"… | [] | Removed legacy synonyms field in favor of structured labels |
| 95,760 | 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 |
| 95,761 | 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 |
| 217,187 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,789 | normalize_name_case | prefLabel | [{"@value":"trimethylphosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"Trimethylphosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,224 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 238,225 | enrich_references | skos_definition | — | [{"@value":"A trialkyl phosphate that is the trimethyl ester of phosphoric acid.","@language":"en","provenance":{"prov:… | Merged ChEBI/PubChem definitions into skos:definition |
| 238,226 | enrich_references | references | [] | [{"@id":"gmelin:49926","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"cons… | Added references with provenance; cas_numbers=['512-56-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_46324']; candidate_pubchem_cids=[10541]; selected_pubchem_cids=[10541]; 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 |
| 251,491 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | rdkit_pre_consensus from 'COP(=O)(OC)OC'; added: monoisotopic_mass |
| 255,983 | chebi_altlabels | altLabel | [] | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Added 9 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 273,009 | consensus_match | prefLabel | [{"@value":"Trimethylphosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributed… | cas=512-56-1; cc_chebi_agreed_name='Trimethyl phosphate'; object_uuid=fo-8d4f375970dc93ff |
| 273,010 | consensus_match | altLabel | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | cas=512-56-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-8d4f375970dc93ff |
| 273,011 | consensus_match | altLabel | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | group_key=trimethylphosphate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=512-56-1; added Common Chemistry CAS names as altLabel: Methyl phosphate, (MeO)<sub>3</sub>PO, NSC 58985; object_uuid=fo-8d4f375970dc93ff |
| 273,012 | consensus_match | cas_match_labels | — | {"512-56-1":"exactMatch"} | group_key=trimethylphosphate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'512-56-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8d4f375970dc93ff: {'512-56-1': 'exactMatch'} |
| 276,669 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Trimethyl phosphate' |
| 283,293 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | rdkit_post_consensus from 'COP(=O)(OC)OC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,638 | strip_catalogue_altlabels | altLabel | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | [{"@value":"O,O,O-Trimethyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttr… | Removed 1 catalogue altLabel value(s): 'NSC 58985' (registry code) |
| 328,871 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 391,017 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9O4P"],… | typed the way the ontology types it |
| 398,880 | 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/20260821T0609040591070000/11603 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v1 |
| ef:activity/change/20260821T0609040591070000/11604 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v2 |
| ef:activity/change/20260821T0609040591070000/11605 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v3 |
| ef:activity/change/20260821T0609040591070000/95760 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v4 |
| ef:activity/change/20260821T0609040591070000/95761 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v5 |
| ef:activity/change/20260821T0609040591070000/217187 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v6 |
| ef:activity/change/20260821T0609040591070000/223789 | prefLabel | ef:agent/normalize_name_case | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v7 |
| ef:activity/change/20260821T0609040591070000/238224 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v8 |
| ef:activity/change/20260821T0609040591070000/238225 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v9 |
| ef:activity/change/20260821T0609040591070000/238226 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v10 |
| ef:activity/change/20260821T0609040591070000/251491 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v11 |
| ef:activity/change/20260821T0609040591070000/255983 | altLabel | ef:agent/chebi_altlabels | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v12 |
| ef:activity/change/20260821T0609040591070000/273009 | prefLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v13 |
| ef:activity/change/20260821T0609040591070000/273010 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v14 |
| ef:activity/change/20260821T0609040591070000/273011 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v15 |
| ef:activity/change/20260821T0609040591070000/273012 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v16 |
| ef:activity/change/20260821T0609040591070000/276669 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v17 |
| ef:activity/change/20260821T0609040591070000/283293 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v18 |
| ef:activity/change/20260821T0609040591070000/289638 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v19 |
| ef:activity/change/20260821T0609040591070000/328871 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v19 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v20 |
| ef:activity/change/20260821T0609040591070000/391017 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v20 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v21 |
| ef:activity/change/20260821T0609040591070000/398880 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v21 | ef:flow/4d9a8790-3ddd-11dd-9d3a-0050c2490048/v22 |