Sorbitan, Trioctadecanoate
Everything that changed this flow. Back to the flow
78eff063-cc7a-4501-96ab-d5d9de47e044
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, link_flows_to_their_substance, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 6 catalogue altLabel value(s): 'E 492' (grade code), 'Emsorb 2507' (trade name), 'S 65' (grade code), 'STS 30' (grade code), 'Span 65' (grade code), 'Span 65V' (grade 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=sorbitan,trioctadecanoate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26658-19-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c86cbd3acef00b25: {'26658-19-5': '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=['26658-19-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[62815, 11320591, 15181202, 17800859, 18392204, 23725024, 70685120, 73555665, 86736698, 133109110]; selected_pubchem_cids=[11320591, 15181202, 17800859, 18392204, 73555665, 133109110]; 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 |
|---|---|---|---|---|---|
| 14,186 | bootstrap_labels | prefLabel | — | [{"@value":"sorbitan, trioctadecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | Bootstrapped prefLabel from legacy name field |
| 14,187 | bootstrap_labels | name | sorbitan, trioctadecanoate | — | Purged legacy name field to enforce prefLabel usage |
| 14,188 | bootstrap_labels | synonyms | ["organic","sorbitantristearate","crill36e","radiamulssorb2345k","radiamulssorb2346k","radiasurf7345","span65","span65v… | [] | Removed legacy synonyms field in favor of structured labels |
| 121,744 | 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 |
| 121,745 | 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 |
| 218,024 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,373 | normalize_name_case | prefLabel | [{"@value":"sorbitan, trioctadecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | [{"@value":"Sorbitan, Trioctadecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,612 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=6) |
| 240,613 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,614 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.043.523","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['26658-19-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[62815, 11320591, 15181202, 17800859, 18392204, 23725024, 70685120, 73555665, 86736698, 133109110]; selected_pubchem_cids=[11320591, 15181202, 17800859, 18392204, 73555665, 133109110]; 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 |
| 252,182 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | rdkit_pre_consensus from 'CCCCCCCCCCCCCCCCCC(=O)OC1COC(C1OC(=O)CCCCCCCCCCCCCCCCC)C(CO)OC(=O)CCCCCCCCCCCCCCCCC'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 272,070 | consensus_match | altLabel | [] | [{"@value":"Admul S 65K","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"con… | group_key=sorbitan,trioctadecanoate||dimension=Environmental > media=Air > indoor=Unknown; cas=26658-19-5; added Common Chemistry CAS names as altLabel: Admul S 65K, Arlacel 65, Armotan TS, Crill 35, E 492, Emasol O 30, Emasol S 30(F), Emasol S 30V, Emsorb 2507, Famodan TS, Glycomul TS, Glycomul TS-K, Grindsted STS 30, Kosteran S 3G, Liposorb TS, Montane 65, Nikkol SS 30, Nikkol SS 30V, Poem S 65F, Poem S 65V, Protachem STS, Rheodol SP-S 30, Rheodol SP-S 30V, S 65, S-Maz 65K, STS 30, Sorbax STS, Sorbester 65, Sorbitan trioctadecanoate, Sorbitan, tristearate, Span 65, Span 65V, Stearic acid triester with sorbitan, Sunsoft 63T, Sunsoft 65T; object_uuid=fo-c86cbd3acef00b25 |
| 272,071 | consensus_match | cas_match_labels | — | {"26658-19-5":"exactMatch"} | group_key=sorbitan,trioctadecanoate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26658-19-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c86cbd3acef00b25: {'26658-19-5': 'exactMatch'} |
| 284,057 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | rdkit_post_consensus from 'CCCCCCCCCCCCCCCCCC(=O)OC1COC(C1OC(=O)CCCCCCCCCCCCCCCCC)C(CO)OC(=O)CCCCCCCCCCCCCCCCC'; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,033 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 4 candidate structures, so no one mass describes it |
| 290,161 | strip_catalogue_altlabels | altLabel | [{"@value":"Admul S 65K","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"con… | [{"@value":"Admul S 65K","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"con… | Removed 6 catalogue altLabel value(s): 'E 492' (grade code), 'Emsorb 2507' (trade name), 'S 65' (grade code), 'STS 30' (grade code), 'Span 65' (grade code), 'Span 65V' (grade code) |
| 341,870 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/78eff063-cc7a-… | associations resolved on the elementary layer |
| 399,901 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 399,902 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C60H114O8"… | 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/20260821T1554374006150000/14186 | prefLabel | ef:agent/bootstrap_labels | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v0 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v1 |
| ef:activity/change/20260821T1554374006150000/14187 | name | ef:agent/bootstrap_labels | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v1 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v2 |
| ef:activity/change/20260821T1554374006150000/14188 | synonyms | ef:agent/bootstrap_labels | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v2 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v3 |
| ef:activity/change/20260821T1554374006150000/121744 | context | ef:agent/default_context_mapping | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v3 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v4 |
| ef:activity/change/20260821T1554374006150000/121745 | context_iri | ef:agent/default_context_mapping | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v4 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v5 |
| ef:activity/change/20260821T1554374006150000/218024 | unit_iri | ef:agent/unit_normalization | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v5 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v6 |
| ef:activity/change/20260821T1554374006150000/224373 | prefLabel | ef:agent/normalize_name_case | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v6 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v7 |
| ef:activity/change/20260821T1554374006150000/240612 | properties | ef:agent/enrich_references | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v7 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v8 |
| ef:activity/change/20260821T1554374006150000/240613 | skos_definition | ef:agent/enrich_references | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v8 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v9 |
| ef:activity/change/20260821T1554374006150000/240614 | references | ef:agent/enrich_references | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v9 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v10 |
| ef:activity/change/20260821T1554374006150000/252182 | properties | ef:agent/rdkit_pre_consensus | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v10 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v11 |
| ef:activity/change/20260821T1554374006150000/272070 | altLabel | ef:agent/consensus_match | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v11 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v12 |
| ef:activity/change/20260821T1554374006150000/272071 | cas_match_labels | ef:agent/consensus_match | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v12 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v13 |
| ef:activity/change/20260821T1554374006150000/284057 | properties | ef:agent/rdkit_post_consensus | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v13 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v14 |
| ef:activity/change/20260821T1554374006150000/287033 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v14 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v15 |
| ef:activity/change/20260821T1554374006150000/290161 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v15 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v16 |
| ef:activity/change/20260821T1554374006150000/341870 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v16 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v17 |
| ef:activity/change/20260821T1554374006150000/399901 | types | ef:agent/link_flows_to_their_substance | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v17 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v18 |
| ef:activity/change/20260821T1554374006150000/399902 | properties | ef:agent/link_flows_to_their_substance | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v18 | ef:flow/78eff063-cc7a-4501-96ab-d5d9de47e044/v19 |