Ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate
Everything that changed this flow. Back to the flow
8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=ethyl9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=68109-88-6; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid, 1,1′-(dioctylstannylene) 4,4′-diethyl ester, 3,8,10-Trioxa-9-stannatetradeca-5,12-dien-14-oic acid, 9,9-dioctyl-4,7,11-trioxo-, ethyl ester; object_uuid=fo-2cc36e88014480a8 |
| cas_match_labels | 1 | consensus_match | group_key=ethyl9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'68109-88-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2cc36e88014480a8: {'68109-88-6': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['68109-88-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[16684108, 53438566, 102269088]; selected_pubchem_cids=[53438566]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 704 | bootstrap_labels | prefLabel | — | [{"@value":"ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate","@language":"en","source… | Bootstrapped prefLabel from legacy name field |
| 705 | bootstrap_labels | name | ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate | — | Purged legacy name field to enforce prefLabel usage |
| 706 | bootstrap_labels | synonyms | ["organometallic","ethyl9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 135,344 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 135,345 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 213,575 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,263 | normalize_name_case | prefLabel | [{"@value":"ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate","@language":"en","source… | [{"@value":"Ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate","@language":"en","source… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,847 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,848 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,849 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=68109-88-6","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['68109-88-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[16684108, 53438566, 102269088]; selected_pubchem_cids=[53438566]; 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 |
| 248,508 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | rdkit_pre_consensus from 'CCCCCCCC[Sn](CCCCCCCC)(OC(=O)C=CC(=O)OCC)OC(=O)C=CC(=O)OCC'; added: molecular_mass, monoisotopic_mass |
| 266,872 | consensus_match | altLabel | [] | [{"@value":"2-Butenedioic acid, 1,1′-(dioctylstannylene) 4,4′-diethyl ester","@language":"en","source":{"prov:wasGenera… | group_key=ethyl9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=68109-88-6; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid, 1,1′-(dioctylstannylene) 4,4′-diethyl ester, 3,8,10-Trioxa-9-stannatetradeca-5,12-dien-14-oic acid, 9,9-dioctyl-4,7,11-trioxo-, ethyl ester; object_uuid=fo-2cc36e88014480a8 |
| 266,873 | consensus_match | cas_match_labels | — | {"68109-88-6":"exactMatch"} | group_key=ethyl9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'68109-88-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2cc36e88014480a8: {'68109-88-6': 'exactMatch'} |
| 273,649 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Ethyl 9,9-dioctyl-4,7,11-trioxo-3,8,10-trioxa-9-stannatetradeca-5,12-dien-14-oate' |
| 280,013 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | rdkit_post_consensus from 'CCCCCCC[CH2][Sn]([CH2]CCCCCCC)([O]C(=O)C=CC(=O)OCC)[O]C(=O)C=CC(=O)OCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 348,688 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8ff33d8f-df5f-… | associations resolved on the elementary layer |
| 387,925 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C28H48O8Sn… | typed the way the ontology types it |
| 394,466 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260820T1416470405690000/704 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v0 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v1 |
| ef:activity/change/20260820T1416470405690000/705 | name | ef:agent/bootstrap_labels | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v1 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v2 |
| ef:activity/change/20260820T1416470405690000/706 | synonyms | ef:agent/bootstrap_labels | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v2 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v3 |
| ef:activity/change/20260820T1416470405690000/135344 | context | ef:agent/default_context_mapping | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v3 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v4 |
| ef:activity/change/20260820T1416470405690000/135345 | context_iri | ef:agent/default_context_mapping | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v4 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v5 |
| ef:activity/change/20260820T1416470405690000/213575 | unit_iri | ef:agent/unit_normalization | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v5 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v6 |
| ef:activity/change/20260820T1416470405690000/221263 | prefLabel | ef:agent/normalize_name_case | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v6 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v7 |
| ef:activity/change/20260820T1416470405690000/227847 | properties | ef:agent/enrich_references | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v7 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v8 |
| ef:activity/change/20260820T1416470405690000/227848 | skos_definition | ef:agent/enrich_references | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v8 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v9 |
| ef:activity/change/20260820T1416470405690000/227849 | references | ef:agent/enrich_references | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v9 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v10 |
| ef:activity/change/20260820T1416470405690000/248508 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v10 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v11 |
| ef:activity/change/20260820T1416470405690000/266872 | altLabel | ef:agent/consensus_match | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v11 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v12 |
| ef:activity/change/20260820T1416470405690000/266873 | cas_match_labels | ef:agent/consensus_match | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v12 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v13 |
| ef:activity/change/20260820T1416470405690000/273649 | properties | ef:agent/opsin_iupac | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v13 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v14 |
| ef:activity/change/20260820T1416470405690000/280013 | properties | ef:agent/rdkit_post_consensus | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v14 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v15 |
| ef:activity/change/20260820T1416470405690000/348688 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v15 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v16 |
| ef:activity/change/20260820T1416470405690000/387925 | properties | ef:agent/normalise_property_values | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v16 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v17 |
| ef:activity/change/20260820T1416470405690000/394466 | types | ef:agent/link_flows_to_their_substance | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v17 | ef:flow/8ff33d8f-df5f-4ae5-b9a1-1c8991ce3ae1/v18 |