5-methoxy-1h-1,3-benzodiazole-2-thiol
Everything that changed this flow. Back to the flow
2ca0b4ed-5073-494a-8a0a-f6d609603070
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=5-methoxy-1h-1,3-benzodiazole-2-thiol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37052-78-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-927c62f8dfc3c6ea: {'37052-78-1': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 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=['37052-78-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[665603, 11447459, 73658967]; selected_pubchem_cids=[665603]; 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 |
|---|---|---|---|---|---|
| 20,216 | bootstrap_labels | prefLabel | — | [{"@value":"5-methoxy-1h-1,3-benzodiazole-2-thiol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels",… | Bootstrapped prefLabel from legacy name field |
| 20,217 | bootstrap_labels | name | 5-methoxy-1h-1,3-benzodiazole-2-thiol | — | Purged legacy name field to enforce prefLabel usage |
| 20,218 | bootstrap_labels | synonyms | ["organic","1,3-dihydro-5-methoxy-2h-benzimidazole-2-thione"] | [] | Removed legacy synonyms field in favor of structured labels |
| 66,560 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 66,561 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 219,894 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 245,883 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,884 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,885 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J260.727A","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['37052-78-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[665603, 11447459, 73658967]; selected_pubchem_cids=[665603]; 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 |
| 253,707 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | rdkit_pre_consensus from 'COC1=CC2=C(C=C1)NC(=S)N2'; added: molecular_mass, monoisotopic_mass |
| 263,112 | consensus_match | altLabel | [] | [{"@value":"1,3-Dihydro-5-methoxy-2<em>H</em>-benzimidazole-2-thione","@language":"en","source":{"prov:wasGeneratedBy":… | group_key=5-methoxy-1h-1,3-benzodiazole-2-thiol||dimension=Environmental > media=Ground > geography=Unknown; cas=37052-78-1; added Common Chemistry CAS names as altLabel: 1,3-Dihydro-5-methoxy-2<em>H</em>-benzimidazole-2-thione, 1,3-Dihydro-5-methoxybenzimidazole-2-thione, 2-Mercapto-5-methoxy-1<em>H</em>-benzimidazole, 2-Mercapto-5-methoxybenzimidazole, 2-Thio-5-methoxy-1<em>H</em>-benzimidazole, 2<em>H</em>-Benzimidazole-2-thione, 1,3-dihydro-5-methoxy-, 5-Methoxy-1<em>H</em>-benzimidazole-2-thiol, 5-Methoxy-1<em>H</em>-benzo[<em>d</em>]imidazole-2(3<em>H</em>)-thione, 5-Methoxy-1<em>H</em>-benzoimidazole-2-thiol, 5-Methoxy-2-benzimidazolethiol, 5-Methoxy-2-mercapto-1<em>H</em>-benzimidazole, 5-Methoxy-2-mercaptobenzimidazole; object_uuid=fo-927c62f8dfc3c6ea |
| 263,113 | consensus_match | cas_match_labels | — | {"37052-78-1":"exactMatch"} | group_key=5-methoxy-1h-1,3-benzodiazole-2-thiol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37052-78-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-927c62f8dfc3c6ea: {'37052-78-1': 'exactMatch'} |
| 278,921 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '5-methoxy-1h-1,3-benzodiazole-2-thiol' |
| 285,729 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | rdkit_post_consensus from 'COc1ccc2[nH]c(S)nc2c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,074 | dedupe_altlabels | altLabel | [{"@value":"1,3-Dihydro-5-methoxy-2<em>H</em>-benzimidazole-2-thione","@language":"en","source":{"prov:wasGeneratedBy":… | [{"@value":"1,3-Dihydro-5-methoxy-2H-benzimidazole-2-thione","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | Deduplicated altLabel values and removed entries matching prefLabel |
| 314,297 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2ca0b4ed-5073-… | associations resolved on the elementary layer |
| 393,300 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H8N2OS"]… | typed the way the ontology types it |
| 402,188 | 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/20260821T1554374006150000/20216 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v0 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v1 |
| ef:activity/change/20260821T1554374006150000/20217 | name | ef:agent/bootstrap_labels | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v1 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v2 |
| ef:activity/change/20260821T1554374006150000/20218 | synonyms | ef:agent/bootstrap_labels | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v2 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v3 |
| ef:activity/change/20260821T1554374006150000/66560 | context | ef:agent/default_context_mapping | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v3 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v4 |
| ef:activity/change/20260821T1554374006150000/66561 | context_iri | ef:agent/default_context_mapping | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v4 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v5 |
| ef:activity/change/20260821T1554374006150000/219894 | unit_iri | ef:agent/unit_normalization | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v5 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v6 |
| ef:activity/change/20260821T1554374006150000/245883 | properties | ef:agent/enrich_references | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v6 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v7 |
| ef:activity/change/20260821T1554374006150000/245884 | skos_definition | ef:agent/enrich_references | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v7 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v8 |
| ef:activity/change/20260821T1554374006150000/245885 | references | ef:agent/enrich_references | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v8 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v9 |
| ef:activity/change/20260821T1554374006150000/253707 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v9 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v10 |
| ef:activity/change/20260821T1554374006150000/263112 | altLabel | ef:agent/consensus_match | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v10 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v11 |
| ef:activity/change/20260821T1554374006150000/263113 | cas_match_labels | ef:agent/consensus_match | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v11 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v12 |
| ef:activity/change/20260821T1554374006150000/278921 | properties | ef:agent/opsin_iupac | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v12 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v13 |
| ef:activity/change/20260821T1554374006150000/285729 | properties | ef:agent/rdkit_post_consensus | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v13 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v14 |
| ef:activity/change/20260821T1554374006150000/293074 | altLabel | ef:agent/dedupe_altlabels | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v14 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v15 |
| ef:activity/change/20260821T1554374006150000/314297 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v15 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v16 |
| ef:activity/change/20260821T1554374006150000/393300 | properties | ef:agent/normalise_property_values | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v16 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v17 |
| ef:activity/change/20260821T1554374006150000/402188 | types | ef:agent/link_flows_to_their_substance | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v17 | ef:flow/2ca0b4ed-5073-494a-8a0a-f6d609603070/v18 |