Phenyl-2-thiourea
Everything that changed this flow. Back to the flow
021f7a54-1d28-479f-90ac-ec2807b502f9
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 5779' (registry code), 'U 6324' (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=phenyl-2-thiourea||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'103-85-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9e76b685b6bf480a: {'103-85-5': '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=['103-85-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_46261']; candidate_pubchem_cids=[67582, 676454, 88838885]; selected_pubchem_cids=[676454]; 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 |
|---|---|---|---|---|---|
| 218 | bootstrap_labels | prefLabel | — | [{"@value":"phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Bootstrapped prefLabel from legacy name field |
| 219 | bootstrap_labels | name | phenyl-2-thiourea | — | Purged legacy name field to enforce prefLabel usage |
| 1,762 | bootstrap_labels | synonyms | [".alpha.-Phenylthiourea","1-PHENYL-2-THIOUREA","1-Phenylthiourea","1bug","2-thiourea, 1-phenyl-","AC-13462","AC1LDWMZ"… | [] | Removed legacy synonyms field in favor of structured labels |
| 27,130 | 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 |
| 27,131 | 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 |
| 213,411 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,143 | normalize_name_case | prefLabel | [{"@value":"phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | [{"@value":"Phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,376 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 227,377 | enrich_references | skos_definition | — | [{"@value":"A member of the class of thioureas that is thiourea in which one of the hydrogens is replaced by a phenyl g… | Merged ChEBI/PubChem definitions into skos:definition |
| 227,378 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.517D","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['103-85-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_46261']; candidate_pubchem_cids=[67582, 676454, 88838885]; selected_pubchem_cids=[676454]; 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 |
| 248,371 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | rdkit_pre_consensus from 'C1=CC=C(C=C1)NC(=S)N'; added: monoisotopic_mass |
| 254,413 | chebi_altlabels | altLabel | [] | [{"@value":"1-phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Added 11 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 270,653 | consensus_match | altLabel | [{"@value":"1-phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"1-phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | group_key=phenyl-2-thiourea||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=103-85-5; added Common Chemistry CAS names as altLabel: <em>N</em>-Phenylthiocarbamide, <em>N</em>-Phenylthiourea, MeSH ID: D010670, NSC 5779, Thiourea, <em>N</em>-phenyl-, Thiourea, phenyl-, U 6324, Urea, 1-phenyl-2-thio-, α-Phenylthiourea; object_uuid=fo-9e76b685b6bf480a |
| 270,654 | consensus_match | cas_match_labels | — | {"103-85-5":"exactMatch"} | group_key=phenyl-2-thiourea||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'103-85-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9e76b685b6bf480a: {'103-85-5': 'exactMatch'} |
| 273,514 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Phenyl-2-thiourea' |
| 279,867 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | rdkit_post_consensus from 'NC(=S)Nc1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,311 | strip_catalogue_altlabels | altLabel | [{"@value":"1-phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"1-phenyl-2-thiourea","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Removed 2 catalogue altLabel value(s): 'NSC 5779' (registry code), 'U 6324' (grade code) |
| 294,629 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/021f7a54-1d28-… | associations resolved on the elementary layer |
| 387,793 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H8N2S"],… | typed the way the ontology types it |
| 394,270 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260820T0738569779880000/218 | prefLabel | ef:agent/bootstrap_labels | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v0 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v1 |
| ef:activity/change/20260820T0738569779880000/219 | name | ef:agent/bootstrap_labels | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v1 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v2 |
| ef:activity/change/20260820T0738569779880000/1762 | synonyms | ef:agent/bootstrap_labels | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v2 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v3 |
| ef:activity/change/20260820T0738569779880000/27130 | context | ef:agent/default_context_mapping | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v3 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v4 |
| ef:activity/change/20260820T0738569779880000/27131 | context_iri | ef:agent/default_context_mapping | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v4 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v5 |
| ef:activity/change/20260820T0738569779880000/213411 | unit_iri | ef:agent/unit_normalization | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v5 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v6 |
| ef:activity/change/20260820T0738569779880000/221143 | prefLabel | ef:agent/normalize_name_case | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v6 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v7 |
| ef:activity/change/20260820T0738569779880000/227376 | properties | ef:agent/enrich_references | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v7 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v8 |
| ef:activity/change/20260820T0738569779880000/227377 | skos_definition | ef:agent/enrich_references | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v8 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v9 |
| ef:activity/change/20260820T0738569779880000/227378 | references | ef:agent/enrich_references | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v9 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v10 |
| ef:activity/change/20260820T0738569779880000/248371 | properties | ef:agent/rdkit_pre_consensus | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v10 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v11 |
| ef:activity/change/20260820T0738569779880000/254413 | altLabel | ef:agent/chebi_altlabels | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v11 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v12 |
| ef:activity/change/20260820T0738569779880000/270653 | altLabel | ef:agent/consensus_match | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v12 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v13 |
| ef:activity/change/20260820T0738569779880000/270654 | cas_match_labels | ef:agent/consensus_match | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v13 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v14 |
| ef:activity/change/20260820T0738569779880000/273514 | properties | ef:agent/opsin_iupac | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v14 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v15 |
| ef:activity/change/20260820T0738569779880000/279867 | properties | ef:agent/rdkit_post_consensus | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v15 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v16 |
| ef:activity/change/20260820T0738569779880000/287311 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v16 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v17 |
| ef:activity/change/20260820T0738569779880000/294629 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v17 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v18 |
| ef:activity/change/20260820T0738569779880000/387793 | properties | ef:agent/normalise_property_values | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v18 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v19 |
| ef:activity/change/20260820T0738569779880000/394270 | types | ef:agent/link_flows_to_their_substance | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v19 | ef:flow/021f7a54-1d28-479f-90ac-ec2807b502f9/v20 |