Trichloro(octyl)stannane
Everything that changed this flow. Back to the flow
d571c823-6f7e-4af6-86c5-f18d011fa0c8
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 1 catalogue altLabel value(s): 'NSC 297508' (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=trichloro(octyl)stannane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3091-25-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9ccf9a2db936cbc7: {'3091-25-6': '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 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=['3091-25-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[76538, 286664, 53435528, 122715472]; selected_pubchem_cids=[76538]; 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 |
|---|---|---|---|---|---|
| 13,993 | bootstrap_labels | prefLabel | — | [{"@value":"trichloro(octyl)stannane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 13,994 | bootstrap_labels | name | trichloro(octyl)stannane | — | Purged legacy name field to enforce prefLabel usage |
| 13,995 | bootstrap_labels | synonyms | ["organometallic","trichlorooctylstannane","mono-n-octyl-zinn-trichlorid[german]","mono-n-octyltintrichloride","motc","… | [] | Removed legacy synonyms field in favor of structured labels |
| 176,222 | 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 |
| 176,223 | 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 |
| 217,961 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,330 | normalize_name_case | prefLabel | [{"@value":"trichloro(octyl)stannane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Trichloro(octyl)stannane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,436 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,437 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,438 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.019.487","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['3091-25-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[76538, 286664, 53435528, 122715472]; selected_pubchem_cids=[76538]; 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 |
| 252,134 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | rdkit_pre_consensus from 'CCCCCCCC[Sn](Cl)(Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 272,825 | consensus_match | altLabel | [] | [{"@value":"<em>n</em>-Octyltin trichloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | group_key=trichloro(octyl)stannane||dimension=Environmental > media=Ground > geography=Agricultural; cas=3091-25-6; added Common Chemistry CAS names as altLabel: <em>n</em>-Octyltin trichloride, <em>n</em>-Octyltrichlorostannane, Mono-<em>n</em>-octyltin trichloride, Monooctyltin trichloride, NSC 297508, Octyltin trichloride, Octyltrichlorostannane, Stannane, trichlorooctyl-, Tin, trichlorooctyl-, Trichloro-<em>n</em>-octylstannane, Trichlorooctylstannane; object_uuid=fo-9ccf9a2db936cbc7 |
| 272,826 | consensus_match | cas_match_labels | — | {"3091-25-6":"exactMatch"} | group_key=trichloro(octyl)stannane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3091-25-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9ccf9a2db936cbc7: {'3091-25-6': 'exactMatch'} |
| 277,325 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Trichloro(octyl)stannane' |
| 284,001 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | rdkit_post_consensus from 'CCCCCCC[CH2][Sn]([Cl])([Cl])[Cl]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,123 | strip_catalogue_altlabels | altLabel | [{"@value":"<em>n</em>-Octyltin trichloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:w… | [{"@value":"n-Octyltin trichloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribu… | Removed 1 catalogue altLabel value(s): 'NSC 297508' (registry code) |
| 369,133 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d571c823-6f7e-… | associations resolved on the elementary layer |
| 391,682 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Cl3Sn… | typed the way the ontology types it |
| 399,819 | 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/20260821T1122181958110000/13993 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v0 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v1 |
| ef:activity/change/20260821T1122181958110000/13994 | name | ef:agent/bootstrap_labels | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v1 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v2 |
| ef:activity/change/20260821T1122181958110000/13995 | synonyms | ef:agent/bootstrap_labels | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v2 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v3 |
| ef:activity/change/20260821T1122181958110000/176222 | context | ef:agent/default_context_mapping | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v3 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v4 |
| ef:activity/change/20260821T1122181958110000/176223 | context_iri | ef:agent/default_context_mapping | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v4 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v5 |
| ef:activity/change/20260821T1122181958110000/217961 | unit_iri | ef:agent/unit_normalization | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v5 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v6 |
| ef:activity/change/20260821T1122181958110000/224330 | prefLabel | ef:agent/normalize_name_case | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v6 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v7 |
| ef:activity/change/20260821T1122181958110000/240436 | properties | ef:agent/enrich_references | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v7 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v8 |
| ef:activity/change/20260821T1122181958110000/240437 | skos_definition | ef:agent/enrich_references | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v8 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v9 |
| ef:activity/change/20260821T1122181958110000/240438 | references | ef:agent/enrich_references | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v9 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v10 |
| ef:activity/change/20260821T1122181958110000/252134 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v10 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v11 |
| ef:activity/change/20260821T1122181958110000/272825 | altLabel | ef:agent/consensus_match | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v11 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v12 |
| ef:activity/change/20260821T1122181958110000/272826 | cas_match_labels | ef:agent/consensus_match | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v12 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v13 |
| ef:activity/change/20260821T1122181958110000/277325 | properties | ef:agent/opsin_iupac | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v13 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v14 |
| ef:activity/change/20260821T1122181958110000/284001 | properties | ef:agent/rdkit_post_consensus | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v14 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v15 |
| ef:activity/change/20260821T1122181958110000/290123 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v15 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v16 |
| ef:activity/change/20260821T1122181958110000/369133 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v16 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v17 |
| ef:activity/change/20260821T1122181958110000/391682 | properties | ef:agent/normalise_property_values | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v17 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v18 |
| ef:activity/change/20260821T1122181958110000/399819 | types | ef:agent/link_flows_to_their_substance | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v18 | ef:flow/d571c823-6f7e-4af6-86c5-f18d011fa0c8/v19 |