Rugulosin, 8,8'-dihydroxy-, (1S,1'S,2R,2'R,3S,3'S,9aR,9'aR)-
Everything that changed this flow. Back to the flow
bcf8399a-6a28-42c8-bae1-d8eba4d870fd
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | typed the way the ontology types it |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=rugulosin,8,8'-dihydroxy-,(1s,1's,2r,2'r,3s,3's,9ar,9'ar)-||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'21884-44-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8b18c1c370762c8d: {'21884-44-6': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['21884-44-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_80711']; candidate_pubchem_cids=[30840, 131876110, 146158127, 156594243, 166639672]; selected_pubchem_cids=[30840]; 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 |
|---|---|---|---|---|---|
| 9,290 | bootstrap_labels | prefLabel | — | [{"@value":"Rugulosin, 8,8'-dihydroxy-, (1S,1'S,2R,2'R,3S,3'S,9aR,9'aR)-","@language":"en","source":{"prov:wasGenerated… | Bootstrapped prefLabel from legacy name field |
| 9,291 | bootstrap_labels | name | Rugulosin, 8,8'-dihydroxy-, (1S,1'S,2R,2'R,3S,3'S,9aR,9'aR)- | — | Purged legacy name field to enforce prefLabel usage |
| 9,292 | bootstrap_labels | synonyms | ["(-)-Luteoskyrin","(1beta,1'beta,3beta,3'beta)-8,8'-Dihydroxy-rugulosin","2,2',3,3'-Tetrahydro-2,2',4,4',5,5',8,8'-oct… | [] | Removed legacy synonyms field in favor of structured labels |
| 161,846 | 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 |
| 161,847 | 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 |
| 216,429 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,068 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1, stereochemistry_restored_cas=['21884-44-6']) |
| 236,069 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,070 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=21884-44-6","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['21884-44-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_80711']; candidate_pubchem_cids=[30840, 131876110, 146158127, 156594243, 166639672]; selected_pubchem_cids=[30840]; 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 |
| 250,871 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | rdkit_pre_consensus from 'CC1=CC(=C2C(=C1O)C(=O)C34C5C6C(C3C(=O)C7=C(C8=C(C=C(C(=C8C(=O)C67C(C5O)C(=O)C4=C2O)O)C)O)O)O)O'; added: monoisotopic_mass |
| 271,511 | consensus_match | altLabel | [] | [{"@value":"(-)-Luteoskyrin","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":… | group_key=rugulosin,8,8'-dihydroxy-,(1s,1's,2r,2'r,3s,3's,9ar,9'ar)-||dimension=Environmental > media=Water > water_body=Long-term; cas=21884-44-6; added Common Chemistry CAS names as altLabel: (-)-Luteoskyrin, (5a<em>R</em>,6<em>S</em>,13a<em>R</em>,14<em>S</em>,17<em>R</em>,18<em>S</em>,19<em>S</em>,20<em>R</em>)-1,4,7,9,12,15,17,20-Octahydroxy-3,11-dimethyl-5<em>H</em>,6<em>H</em>-6,13a,5a,14-[1,2,3,4]butanetetraylcycloocta[1,2-<em>b</em>:5,6-<em>b</em>′]dinaphthalene-5,8,13,16(14<em>H</em>)-tetrone, 5<em>H</em>,6<em>H</em>-6,13a,5a,14-[1,2,3,4]Butanetetraylcycloocta[1,2-<em>b</em>:5,6-<em>b</em>′]dinaphthalene, rugulosin deriv., 5<em>H</em>,6<em>H</em>-6,13a,5a,14-[1,2,3,4]Butanetetraylcycloocta[1,2-<em>b</em>:5,6-<em>b</em>′]dinaphthalene-5,8,13,16(14<em>H</em>)-tetrone, 1,4,7,9,12,15,17,20-octahydroxy-3,11-dimethyl-, 5<em>H</em>,6<em>H</em>-6,13a,5a,14-[1,2,3,4]Butanetetraylcycloocta[1,2-<em>b</em>:5,6-<em>b</em>′]dinaphthalene-5,8,13,16(14<em>H</em>)-tetrone, 1,4,7,9,12,15,17,20-octahydroxy-3,11-dimethyl-, (5a<em>R</em>,6<em>S</em>,13a<em>R</em>,14<em>S</em>,17<em>R</em>,18<em>S</em>,19<em>S</em>,20<em>R</em>)-, 5<em>H</em>,6<em>H</em>-6,13a,5a,14-[1,2,3,4]Butanetetraylcycloocta[1,2-<em>b</em>:5,6-<em>b</em>′]dinaphthalene-5,8,13,16(14<em>H</em>)-tetrone, 1,4,7,9,12,15,17,20-octahydroxy-3,11-dimethyl-, [5a<em>R</em>-(5a<em>R</em>*,6<em>S</em>*,13a<em>R</em>*,14<em>S</em>*,17<em>R</em>*,18<em>S</em>*,19<em>S</em>*,20<em>R</em>*)]-, Luteoskyrin, Luteoskyrin, (-)-, Rugulosin, 8,8′-dihydroxy-, (1<em>S</em>,1′<em>S</em>,2<em>R</em>,2′<em>R</em>,3<em>S</em>,3′<em>S</em>,9a<em>R</em>,9′a<em>R</em>)-; object_uuid=fo-8b18c1c370762c8d |
| 271,512 | consensus_match | cas_match_labels | — | {"21884-44-6":"exactMatch"} | group_key=rugulosin,8,8'-dihydroxy-,(1s,1's,2r,2'r,3s,3's,9ar,9'ar)-||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'21884-44-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8b18c1c370762c8d: {'21884-44-6': 'exactMatch'} |
| 282,630 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | rdkit_post_consensus from 'CC1=CC(=C2C(=C1O)C(=O)C34C5C6C(C3C(=O)C7=C(C8=C(C=C(C(=C8C(=O)C67C(C5O)C(=O)C4=C2O)O)C)O)O)O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,908 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 292,435 | dedupe_altlabels | altLabel | [{"@value":"(-)-Luteoskyrin","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":… | [{"@value":"(-)-Luteoskyrin","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":… | Deduplicated altLabel values and removed entries matching prefLabel |
| 361,948 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/bcf8399a-6a28-… | associations resolved on the elementary layer |
| 390,403 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C30H22O12"… | typed the way the ontology types it |
| 397,996 | 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/20260821T1554374006150000/9290 | prefLabel | ef:agent/bootstrap_labels | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v0 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v1 |
| ef:activity/change/20260821T1554374006150000/9291 | name | ef:agent/bootstrap_labels | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v1 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v2 |
| ef:activity/change/20260821T1554374006150000/9292 | synonyms | ef:agent/bootstrap_labels | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v2 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v3 |
| ef:activity/change/20260821T1554374006150000/161846 | context | ef:agent/default_context_mapping | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v3 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v4 |
| ef:activity/change/20260821T1554374006150000/161847 | context_iri | ef:agent/default_context_mapping | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v4 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v5 |
| ef:activity/change/20260821T1554374006150000/216429 | unit_iri | ef:agent/unit_normalization | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v5 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v6 |
| ef:activity/change/20260821T1554374006150000/236068 | properties | ef:agent/enrich_references | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v6 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v7 |
| ef:activity/change/20260821T1554374006150000/236069 | skos_definition | ef:agent/enrich_references | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v7 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v8 |
| ef:activity/change/20260821T1554374006150000/236070 | references | ef:agent/enrich_references | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v8 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v9 |
| ef:activity/change/20260821T1554374006150000/250871 | properties | ef:agent/rdkit_pre_consensus | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v9 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v10 |
| ef:activity/change/20260821T1554374006150000/271511 | altLabel | ef:agent/consensus_match | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v10 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v11 |
| ef:activity/change/20260821T1554374006150000/271512 | cas_match_labels | ef:agent/consensus_match | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v11 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v12 |
| ef:activity/change/20260821T1554374006150000/282630 | properties | ef:agent/rdkit_post_consensus | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v12 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v13 |
| ef:activity/change/20260821T1554374006150000/286908 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v13 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v14 |
| ef:activity/change/20260821T1554374006150000/292435 | altLabel | ef:agent/dedupe_altlabels | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v14 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v15 |
| ef:activity/change/20260821T1554374006150000/361948 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v15 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v16 |
| ef:activity/change/20260821T1554374006150000/390403 | properties | ef:agent/normalise_property_values | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v16 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v17 |
| ef:activity/change/20260821T1554374006150000/397996 | types | ef:agent/link_flows_to_their_substance | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v17 | ef:flow/bcf8399a-6a28-42c8-bae1-d8eba4d870fd/v18 |