2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole
Everything that changed this flow. Back to the flow
08a91e70-3ddc-11dd-92d1-0050c2490048
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 53279' (registry code), 'NSC 78274' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'712-68-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-02825c039d62c064: {'712-68-5': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 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=['712-68-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82286']; candidate_pubchem_cids=[61205]; selected_pubchem_cids=[61205]; 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 |
|---|---|---|---|---|---|
| 7,211 | bootstrap_labels | prefLabel | — | [{"@value":"2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_… | Bootstrapped prefLabel from legacy name field |
| 7,212 | bootstrap_labels | name | 2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole | — | Purged legacy name field to enforce prefLabel usage |
| 7,213 | bootstrap_labels | synonyms | ["1,3,4-Thiadiazol-2-amine, 5-(5-nitro-2-furanyl)-","1,3,4-Thiadiazol-2-amine, 5-(5-nitro-2-furanyl)- (9CI)","1,3,4-Thi… | [] | Removed legacy synonyms field in favor of structured labels |
| 33,438 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 33,439 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 215,746 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 234,094 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 234,095 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 234,096 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.943D","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['712-68-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82286']; candidate_pubchem_cids=[61205]; selected_pubchem_cids=[61205]; 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 |
| 250,311 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | rdkit_pre_consensus from 'C1=C(OC(=C1)[N+](=O)[O-])C2=NN=C(S2)N'; added: monoisotopic_mass |
| 255,305 | chebi_altlabels | altLabel | [] | [{"@value":"Triafur","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Added 1 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,503 | consensus_match | altLabel | [{"@value":"Triafur","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"Triafur","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | group_key=2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole||dimension=Environmental > media=Water > water_body=Ocean; cas=712-68-5; added Common Chemistry CAS names as altLabel: 1,3,4-Thiadiazol-2-amine, 5-(5-nitro-2-furanyl)-, 1,3,4-Thiadiazole, 2-amino-5-(5-nitro-2-furyl)-, 2-[5-Nitro-2-furyl]-5-amino-1,3,4-thiadiazole, 5-(5-Nitro-2-furanyl)-1,3,4-thiadiazol-2-amine, Furidiazina, NSC 53279, NSC 78274, Thiafur, Tiafur; object_uuid=fo-02825c039d62c064 |
| 260,504 | consensus_match | cas_match_labels | — | {"712-68-5":"exactMatch"} | group_key=2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'712-68-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-02825c039d62c064: {'712-68-5': 'exactMatch'} |
| 275,455 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole' |
| 281,975 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | rdkit_post_consensus from 'Nc1nnc(-c2ccc([N+](=O)[O-])o2)s1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,734 | strip_catalogue_altlabels | altLabel | [{"@value":"Triafur","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"Triafur","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Removed 2 catalogue altLabel value(s): 'NSC 53279' (registry code), 'NSC 78274' (registry code) |
| 297,751 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 389,768 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4N4O3S"… | typed the way the ontology types it |
| 397,073 | 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/20260821T1122181958110000/7211 | prefLabel | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v0 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v1 |
| ef:activity/change/20260821T1122181958110000/7212 | name | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v1 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v2 |
| ef:activity/change/20260821T1122181958110000/7213 | synonyms | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v2 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v3 |
| ef:activity/change/20260821T1122181958110000/33438 | context | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v3 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v4 |
| ef:activity/change/20260821T1122181958110000/33439 | context_iri | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v4 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v5 |
| ef:activity/change/20260821T1122181958110000/215746 | unit_iri | ef:agent/unit_normalization | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v5 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v6 |
| ef:activity/change/20260821T1122181958110000/234094 | properties | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v6 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v7 |
| ef:activity/change/20260821T1122181958110000/234095 | skos_definition | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v7 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v8 |
| ef:activity/change/20260821T1122181958110000/234096 | references | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v8 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v9 |
| ef:activity/change/20260821T1122181958110000/250311 | properties | ef:agent/rdkit_pre_consensus | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v9 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v10 |
| ef:activity/change/20260821T1122181958110000/255305 | altLabel | ef:agent/chebi_altlabels | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v10 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v11 |
| ef:activity/change/20260821T1122181958110000/260503 | altLabel | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v11 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v12 |
| ef:activity/change/20260821T1122181958110000/260504 | cas_match_labels | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v12 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v13 |
| ef:activity/change/20260821T1122181958110000/275455 | properties | ef:agent/opsin_iupac | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v13 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v14 |
| ef:activity/change/20260821T1122181958110000/281975 | properties | ef:agent/rdkit_post_consensus | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v14 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v15 |
| ef:activity/change/20260821T1122181958110000/288734 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v15 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v16 |
| ef:activity/change/20260821T1122181958110000/297751 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v16 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v17 |
| ef:activity/change/20260821T1122181958110000/389768 | properties | ef:agent/normalise_property_values | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v17 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v18 |
| ef:activity/change/20260821T1122181958110000/397073 | types | ef:agent/link_flows_to_their_substance | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v18 | ef:flow/08a91e70-3ddc-11dd-92d1-0050c2490048/v19 |