Sucrose Acetate Isobutyrate
Everything that changed this flow. Back to the flow
b57f58a7-975e-4262-9b41-f706de0285ba
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus | the substance's answer, copied onto its flow |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 3 catalogue altLabel value(s): 'E 444' (grade code), 'SAIB 100' (grade code), 'SAIB 100S' (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=sucroseacetateisobutyrate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'126-13-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ed5e76fefe874575: {'126-13-6': '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 air > Emissions to urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['126-13-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_177717']; candidate_pubchem_cids=[31339, 2735139, 17967112, 22061885, 53792017, 131698968, 170836406]; selected_pubchem_cids=[31339]; 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 |
|---|---|---|---|---|---|
| 12,989 | bootstrap_labels | prefLabel | — | [{"@value":"sucrose acetate isobutyrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Bootstrapped prefLabel from legacy name field |
| 12,990 | bootstrap_labels | name | sucrose acetate isobutyrate | — | Purged legacy name field to enforce prefLabel usage |
| 12,991 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 157,584 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 157,585 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 217,634 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,099 | normalize_name_case | prefLabel | [{"@value":"sucrose acetate isobutyrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | [{"@value":"Sucrose Acetate Isobutyrate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 239,504 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 239,505 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,506 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.004.338","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['126-13-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_177717']; candidate_pubchem_cids=[31339, 2735139, 17967112, 22061885, 53792017, 131698968, 170836406]; selected_pubchem_cids=[31339]; 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 |
| 256,161 | chebi_altlabels | altLabel | [] | [{"@value":"[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)… | Added 1 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,140 | consensus_match | altLabel | [{"@value":"[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)… | [{"@value":"[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)… | group_key=sucroseacetateisobutyrate||dimension=Environmental > media=Water > water_body=Unknown; cas=126-13-6; added Common Chemistry CAS names as altLabel: Binester SAAB, E 444, Isobutyric acid, hexaester with sucrose diacetate, SAIB, SAIB 100, SAIB 100S, SAIB FG, Saccharose acetate isobutyrate, Sucrose acetate isobutanoate, Sucrose acetoisobutyrate, Sucrose, diacetate hexaisobutyrate, Sustane SAIB MCT, Sustane SAIB-ET 10, α-<span class="text-smallcaps">D</smallcap>-Glucopyranoside, 6-<em>O</em>-acetyl-1,3,4-tris-<em>O</em>-(2-methyl-1-oxopropyl)-β-<smallcap>D</span>-fructofuranosyl, 6-acetate 2,3,4-tris(2-methylpropanoate); object_uuid=fo-ed5e76fefe874575 |
| 272,141 | consensus_match | cas_match_labels | — | {"126-13-6":"exactMatch"} | group_key=sucroseacetateisobutyrate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'126-13-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ed5e76fefe874575: {'126-13-6': 'exactMatch'} |
| 277,053 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)oxan-2-yl]oxy-3,4-bis(2-methylpropanoyloxy)oxolan-2-yl]methyl 2-methylpropanoate' |
| 283,707 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | rdkit_post_consensus from 'CC(=O)OC[C@H]1O[C@H](O[C@]2(COC(C)=O)O[C@H](COC(=O)C(C)C)[C@@H](OC(=O)C(C)C)[C@@H]2OC(=O)C(C)C)[C@H](OC(=O)C(C)C)[C@@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,924 | strip_catalogue_altlabels | altLabel | [{"@value":"[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)… | [{"@value":"[(2R,3R,4S,5S)-5-(acetyloxymethyl)-5-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3,4,5-tris(2-methylpropanoyloxy)… | Removed 3 catalogue altLabel value(s): 'E 444' (grade code), 'SAIB 100' (grade code), 'SAIB 100S' (grade code) |
| 359,817 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b57f58a7-975e-… | associations resolved on the elementary layer |
| 391,404 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | typed the way the ontology types it |
| 399,422 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 399,423 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C40H62O19"… | 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/20260821T1302361922970000/12989 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v0 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v1 |
| ef:activity/change/20260821T1302361922970000/12990 | name | ef:agent/bootstrap_labels | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v1 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v2 |
| ef:activity/change/20260821T1302361922970000/12991 | synonyms | ef:agent/bootstrap_labels | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v2 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v3 |
| ef:activity/change/20260821T1302361922970000/157584 | context | ef:agent/default_context_mapping | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v3 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v4 |
| ef:activity/change/20260821T1302361922970000/157585 | context_iri | ef:agent/default_context_mapping | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v4 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v5 |
| ef:activity/change/20260821T1302361922970000/217634 | unit_iri | ef:agent/unit_normalization | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v5 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v6 |
| ef:activity/change/20260821T1302361922970000/224099 | prefLabel | ef:agent/normalize_name_case | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v6 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v7 |
| ef:activity/change/20260821T1302361922970000/239504 | properties | ef:agent/enrich_references | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v7 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v8 |
| ef:activity/change/20260821T1302361922970000/239505 | skos_definition | ef:agent/enrich_references | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v8 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v9 |
| ef:activity/change/20260821T1302361922970000/239506 | references | ef:agent/enrich_references | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v9 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v10 |
| ef:activity/change/20260821T1302361922970000/256161 | altLabel | ef:agent/chebi_altlabels | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v10 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v11 |
| ef:activity/change/20260821T1302361922970000/272140 | altLabel | ef:agent/consensus_match | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v11 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v12 |
| ef:activity/change/20260821T1302361922970000/272141 | cas_match_labels | ef:agent/consensus_match | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v12 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v13 |
| ef:activity/change/20260821T1302361922970000/277053 | properties | ef:agent/opsin_iupac | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v13 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v14 |
| ef:activity/change/20260821T1302361922970000/283707 | properties | ef:agent/rdkit_post_consensus | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v14 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v15 |
| ef:activity/change/20260821T1302361922970000/289924 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v15 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v16 |
| ef:activity/change/20260821T1302361922970000/359817 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v16 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v17 |
| ef:activity/change/20260821T1302361922970000/391404 | properties | ef:agent/normalise_property_values | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v17 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v18 |
| ef:activity/change/20260821T1302361922970000/399422 | types | ef:agent/link_flows_to_their_substance | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v18 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v19 |
| ef:activity/change/20260821T1302361922970000/399423 | properties | ef:agent/link_flows_to_their_substance | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v19 | ef:flow/b57f58a7-975e-4262-9b41-f706de0285ba/v20 |