Isopropyl Isodecanoate
Everything that changed this flow. Back to the flow
63e95798-898e-47f5-b607-e53781cc0288
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 4 catalogue altLabel value(s): 'Prisorine 2021' (trade name), 'Schercemol 318' (trade name), 'Wickenol 131' (trade name), 'Witconol 2310' (trade name) |
| 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=isopropylisodecanoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'68171-33-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0b26cc2f3e904f3b: {'68171-33-5': '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 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=['68171-33-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[94625, 128743]; selected_pubchem_cids=[94625]; 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 |
|---|---|---|---|---|---|
| 15,249 | bootstrap_labels | prefLabel | — | [{"@value":"isopropyl isodecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | Bootstrapped prefLabel from legacy name field |
| 15,250 | bootstrap_labels | name | isopropyl isodecanoate | — | Purged legacy name field to enforce prefLabel usage |
| 15,251 | bootstrap_labels | synonyms | ["organic","isopropylisodecanoate","crodamolipis","dubisip","radia7739"] | [] | Removed legacy synonyms field in favor of structured labels |
| 109,026 | 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 |
| 109,027 | 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 |
| 218,359 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,606 | normalize_name_case | prefLabel | [{"@value":"isopropyl isodecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | [{"@value":"Isopropyl Isodecanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,576 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,577 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,578 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J24.705G","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['68171-33-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[94625, 128743]; selected_pubchem_cids=[94625]; 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 |
| 252,464 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | rdkit_pre_consensus from 'CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C'; added: molecular_mass, monoisotopic_mass |
| 268,189 | consensus_match | altLabel | [] | [{"@value":"Crodamol IPIS","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"c… | group_key=isopropylisodecanoate||dimension=Environmental > media=Water > water_body=Long-term; cas=68171-33-5; added Common Chemistry CAS names as altLabel: Crodamol IPIS, Isooctadecanoic acid, 1-methylethyl ester, Isopropyl isostearate, Nikkol EPIS, Nikkol IPIS, Prisorine 2021, Prisorine IPIS 2021, Schercemol 318, Unimate IPIS, Wickenol 131, Witconol 2310; object_uuid=fo-0b26cc2f3e904f3b |
| 268,190 | consensus_match | cas_match_labels | — | {"68171-33-5":"exactMatch"} | group_key=isopropylisodecanoate||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'68171-33-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0b26cc2f3e904f3b: {'68171-33-5': 'exactMatch'} |
| 277,660 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Isooctadecanoic acid, 1-methylethyl ester' |
| 284,359 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | rdkit_post_consensus from 'CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,365 | strip_catalogue_altlabels | altLabel | [{"@value":"Crodamol IPIS","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"c… | [{"@value":"Crodamol IPIS","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"c… | Removed 4 catalogue altLabel value(s): 'Prisorine 2021' (trade name), 'Schercemol 318' (trade name), 'Wickenol 131' (trade name), 'Witconol 2310' (trade name) |
| 335,511 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/63e95798-898e-… | associations resolved on the elementary layer |
| 392,014 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C21H42O2"]… | typed the way the ontology types it |
| 400,296 | 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/20260822T0600486828500000/15249 | prefLabel | ef:agent/bootstrap_labels | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v0 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v1 |
| ef:activity/change/20260822T0600486828500000/15250 | name | ef:agent/bootstrap_labels | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v1 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v2 |
| ef:activity/change/20260822T0600486828500000/15251 | synonyms | ef:agent/bootstrap_labels | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v2 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v3 |
| ef:activity/change/20260822T0600486828500000/109026 | context | ef:agent/default_context_mapping | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v3 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v4 |
| ef:activity/change/20260822T0600486828500000/109027 | context_iri | ef:agent/default_context_mapping | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v4 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v5 |
| ef:activity/change/20260822T0600486828500000/218359 | unit_iri | ef:agent/unit_normalization | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v5 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v6 |
| ef:activity/change/20260822T0600486828500000/224606 | prefLabel | ef:agent/normalize_name_case | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v6 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v7 |
| ef:activity/change/20260822T0600486828500000/241576 | properties | ef:agent/enrich_references | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v7 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v8 |
| ef:activity/change/20260822T0600486828500000/241577 | skos_definition | ef:agent/enrich_references | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v8 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v9 |
| ef:activity/change/20260822T0600486828500000/241578 | references | ef:agent/enrich_references | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v9 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v10 |
| ef:activity/change/20260822T0600486828500000/252464 | properties | ef:agent/rdkit_pre_consensus | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v10 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v11 |
| ef:activity/change/20260822T0600486828500000/268189 | altLabel | ef:agent/consensus_match | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v11 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v12 |
| ef:activity/change/20260822T0600486828500000/268190 | cas_match_labels | ef:agent/consensus_match | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v12 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v13 |
| ef:activity/change/20260822T0600486828500000/277660 | properties | ef:agent/opsin_iupac | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v13 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v14 |
| ef:activity/change/20260822T0600486828500000/284359 | properties | ef:agent/rdkit_post_consensus | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v14 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v15 |
| ef:activity/change/20260822T0600486828500000/290365 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v15 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v16 |
| ef:activity/change/20260822T0600486828500000/335511 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v16 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v17 |
| ef:activity/change/20260822T0600486828500000/392014 | properties | ef:agent/normalise_property_values | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v17 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v18 |
| ef:activity/change/20260822T0600486828500000/400296 | types | ef:agent/link_flows_to_their_substance | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v18 | ef:flow/63e95798-898e-47f5-b607-e53781cc0288/v19 |