Diethyl Tartrate
Everything that changed this flow. Back to the flow
70350bfe-0e61-40bc-9d1c-b952aec41286
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 44808' (registry code), 'NSC 8878' (registry 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=diethyltartrate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'87-91-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a98acd0a904ad59e: {'87-91-2': '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=['87-91-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[62333, 117410, 134107, 638139, 6993580]; selected_pubchem_cids=[6993580]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 13,179 | bootstrap_labels | prefLabel | — | [{"@value":"diethyl tartrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 13,180 | bootstrap_labels | name | diethyl tartrate | — | Purged legacy name field to enforce prefLabel usage |
| 13,181 | bootstrap_labels | synonyms | ["(+)-DIETHYL-L-TARTRATE","(+)-Diethyl L-tartrate","(+)-Tartaric acid diethyl ester","(-)-DIETHYL-D-TARTRATE","AB100309… | [] | Removed legacy synonyms field in favor of structured labels |
| 116,584 | 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 |
| 116,585 | 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 |
| 217,695 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,147 | normalize_name_case | prefLabel | [{"@value":"diethyl tartrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Diethyl Tartrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,679 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,680 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,681 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.319J","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['87-91-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[62333, 117410, 134107, 638139, 6993580]; selected_pubchem_cids=[6993580]; 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 |
| 251,911 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | rdkit_pre_consensus from 'CCOC(=O)C(C(C(=O)OCC)O)O'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 265,929 | consensus_match | altLabel | [] | [{"@value":"(+)-(<em>R</em>,<em>R</em>)-Diethyl tartrate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | group_key=diethyltartrate||dimension=Environmental > media=Water > water_body=Long-term; cas=87-91-2; added Common Chemistry CAS names as altLabel: (+)-(<em>R</em>,<em>R</em>)-Diethyl tartrate, (+)-Diethyl <span class="text-smallcaps">L</span>-tartrate, (+)-Diethyl L-tartarate, (<em>R</em>,<em>R</em>)-Diethyl tartrate, (<em>R</em>,<em>R</em>)-Tartaric acid diethyl ester, <span class="text-smallcaps">L</span>-(+)-Tartaric acid diethyl ester, <span class="text-smallcaps">L</span>-Diethyl tartrate, <span class="text-smallcaps">L</span>-Tartaric acid diethyl ester, Butanedioic acid, 2,3-dihydroxy- (2<em>R</em>,3<em>R</em>)-, 1,4-diethyl ester, Butanedioic acid, 2,3-dihydroxy- (2<em>R</em>,3<em>R</em>)-, diethyl ester, Butanedioic acid, 2,3-dihydroxy-[<em>R</em>-(<em>R</em>*,<em>R</em>*)]-, diethyl ester, Diethyl (+)-tartrate, Diethyl (2<em>R</em>,3<em>R</em>)-(+)-tartrate, Diethyl (2<em>R</em>,3<em>R</em>)-2,3-dihydroxysuccinate, Diethyl (2<em>R</em>,3<em>R</em>)-tartrate, Diethyl (<em>R</em>,<em>R</em>)-(+)-tartrate, Diethyl (R,R)-tartrate, Diethyl 1,2-dihydroxy-1,2-ethanedicarboxylate, Diethyl <span class="text-smallcaps">L</span>-(+)-tartrate, Diethyl <span class="text-smallcaps">L</span>-tartarate, Diethyl <span class="text-smallcaps">L</span>-tartrate, Diethyl tartarate, Ethyl (+)-tartrate, Ethyl tartrate, NSC 44808, NSC 8878, Tartaric acid, diethyl ester; object_uuid=fo-a98acd0a904ad59e |
| 265,930 | consensus_match | cas_match_labels | — | {"87-91-2":"exactMatch"} | group_key=diethyltartrate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'87-91-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a98acd0a904ad59e: {'87-91-2': 'exactMatch'} |
| 277,104 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(+)-(R,R)-Diethyl tartrate' |
| 283,764 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | rdkit_post_consensus from 'CCOC(=O)[C@H](O)[C@@H](O)C(=O)OCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,965 | strip_catalogue_altlabels | altLabel | [{"@value":"(+)-(<em>R</em>,<em>R</em>)-Diethyl tartrate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | [{"@value":"(+)-(R,R)-Diethyl tartrate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | Removed 2 catalogue altLabel value(s): 'NSC 44808' (registry code), 'NSC 8878' (registry code) |
| 339,291 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/70350bfe-0e61-… | associations resolved on the elementary layer |
| 391,454 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | typed the way the ontology types it |
| 399,492 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 399,493 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H14O6"],… | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260822T0600486828500000/13179 | prefLabel | ef:agent/bootstrap_labels | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v0 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v1 |
| ef:activity/change/20260822T0600486828500000/13180 | name | ef:agent/bootstrap_labels | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v1 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v2 |
| ef:activity/change/20260822T0600486828500000/13181 | synonyms | ef:agent/bootstrap_labels | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v2 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v3 |
| ef:activity/change/20260822T0600486828500000/116584 | context | ef:agent/default_context_mapping | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v3 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v4 |
| ef:activity/change/20260822T0600486828500000/116585 | context_iri | ef:agent/default_context_mapping | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v4 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v5 |
| ef:activity/change/20260822T0600486828500000/217695 | unit_iri | ef:agent/unit_normalization | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v5 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v6 |
| ef:activity/change/20260822T0600486828500000/224147 | prefLabel | ef:agent/normalize_name_case | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v6 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v7 |
| ef:activity/change/20260822T0600486828500000/239679 | properties | ef:agent/enrich_references | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v7 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v8 |
| ef:activity/change/20260822T0600486828500000/239680 | skos_definition | ef:agent/enrich_references | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v8 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v9 |
| ef:activity/change/20260822T0600486828500000/239681 | references | ef:agent/enrich_references | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v9 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v10 |
| ef:activity/change/20260822T0600486828500000/251911 | properties | ef:agent/rdkit_pre_consensus | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v10 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v11 |
| ef:activity/change/20260822T0600486828500000/265929 | altLabel | ef:agent/consensus_match | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v11 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v12 |
| ef:activity/change/20260822T0600486828500000/265930 | cas_match_labels | ef:agent/consensus_match | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v12 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v13 |
| ef:activity/change/20260822T0600486828500000/277104 | properties | ef:agent/opsin_iupac | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v13 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v14 |
| ef:activity/change/20260822T0600486828500000/283764 | properties | ef:agent/rdkit_post_consensus | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v14 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v15 |
| ef:activity/change/20260822T0600486828500000/289965 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v15 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v16 |
| ef:activity/change/20260822T0600486828500000/339291 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v16 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v17 |
| ef:activity/change/20260822T0600486828500000/391454 | properties | ef:agent/normalise_property_values | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v17 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v18 |
| ef:activity/change/20260822T0600486828500000/399492 | types | ef:agent/link_flows_to_their_substance | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v18 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v19 |
| ef:activity/change/20260822T0600486828500000/399493 | properties | ef:agent/link_flows_to_their_substance | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v19 | ef:flow/70350bfe-0e61-40bc-9d1c-b952aec41286/v20 |