Nitroguanidine
Everything that changed this flow. Back to the flow
4bb2a74c-3350-4d67-8afe-f62cb8774282
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| altLabel | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 41036' (registry code) |
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=556-88-7; cc_chebi_agreed_name='Nitroguanidine'; object_uuid=fo-3b9bacee714592d2 |
| cas_match_labels | 1 | consensus_match | group_key=1-nitroguanidine||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'556-88-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3b9bacee714592d2: {'556-88-7': '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 (long-term) |
| 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 (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['556-88-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39179']; candidate_pubchem_cids=[11174, 71742255, 86287517]; selected_pubchem_cids=[]; 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 |
|---|---|---|---|---|---|
| 20,038 | bootstrap_labels | prefLabel | — | [{"@value":"1-nitroguanidine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 20,039 | bootstrap_labels | name | 1-nitroguanidine | — | Purged legacy name field to enforce prefLabel usage |
| 20,040 | bootstrap_labels | synonyms | ["organic","1-nitroguanidine","nigu"] | [] | Removed legacy synonyms field in favor of structured labels |
| 86,142 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 86,143 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 219,842 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 245,741 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=0) |
| 245,742 | enrich_references | skos_definition | — | [{"@value":"An N-nitro compound that is guanidine in which one of the hydrogens is replaced by a nitro group. It can ex… | Merged ChEBI/PubChem definitions into skos:definition |
| 245,743 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=556-88-7","provenance":{"prov:wasGeneratedBy":"enrich_references… | Added references with provenance; cas_numbers=['556-88-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39179']; candidate_pubchem_cids=[11174, 71742255, 86287517]; selected_pubchem_cids=[]; 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 |
| 256,973 | chebi_altlabels | altLabel | [] | [{"@value":"nitroguanidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | Added 2 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 259,261 | consensus_match | prefLabel | [{"@value":"1-nitroguanidine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Nitroguanidine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | cas=556-88-7; cc_chebi_agreed_name='Nitroguanidine'; object_uuid=fo-3b9bacee714592d2 |
| 259,262 | consensus_match | altLabel | [{"@value":"nitroguanidine","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | [{"@value":"picrite","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | cas=556-88-7; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-3b9bacee714592d2 |
| 259,263 | consensus_match | altLabel | [{"@value":"picrite","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"picrite","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | group_key=1-nitroguanidine||dimension=Environmental > media=Air > indoor=Unknown; cas=556-88-7; added Common Chemistry CAS names as altLabel: 2-Nitroguanidine, <em>N</em>-Nitroguanidine, <em>N</em><sup>1</sup>-Nitroguanidine, <em>N</em>′′-Nitroguanidine, Guanidine, <em>N</em>-nitro-, Guanidine, nitro-, Lovex D 380, NQ, NSC 41036, Picrite (propellant), α-Nitroguanidine, β-Nitroguanidine; object_uuid=fo-3b9bacee714592d2 |
| 259,264 | consensus_match | cas_match_labels | — | {"556-88-7":"exactMatch"} | group_key=1-nitroguanidine||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'556-88-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3b9bacee714592d2: {'556-88-7': 'exactMatch'} |
| 278,880 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Nitroguanidine' |
| 285,685 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | rdkit_post_consensus from 'N=C(N)N[N+](=O)[O-]'; added: inchi2d_key_string, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string, molecular_formula |
| 291,254 | strip_catalogue_altlabels | altLabel | [{"@value":"picrite","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | [{"@value":"picrite","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consens… | Removed 1 catalogue altLabel value(s): 'NSC 41036' (registry code) |
| 324,087 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4bb2a74c-3350-… | associations resolved on the elementary layer |
| 393,257 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH4N4O2"],… | typed the way the ontology types it |
| 402,132 | 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/20260822T0600486828500000/20038 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v0 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v1 |
| ef:activity/change/20260822T0600486828500000/20039 | name | ef:agent/bootstrap_labels | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v1 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v2 |
| ef:activity/change/20260822T0600486828500000/20040 | synonyms | ef:agent/bootstrap_labels | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v2 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v3 |
| ef:activity/change/20260822T0600486828500000/86142 | context | ef:agent/default_context_mapping | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v3 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v4 |
| ef:activity/change/20260822T0600486828500000/86143 | context_iri | ef:agent/default_context_mapping | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v4 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v5 |
| ef:activity/change/20260822T0600486828500000/219842 | unit_iri | ef:agent/unit_normalization | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v5 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v6 |
| ef:activity/change/20260822T0600486828500000/245741 | properties | ef:agent/enrich_references | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v6 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v7 |
| ef:activity/change/20260822T0600486828500000/245742 | skos_definition | ef:agent/enrich_references | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v7 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v8 |
| ef:activity/change/20260822T0600486828500000/245743 | references | ef:agent/enrich_references | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v8 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v9 |
| ef:activity/change/20260822T0600486828500000/256973 | altLabel | ef:agent/chebi_altlabels | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v9 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v10 |
| ef:activity/change/20260822T0600486828500000/259261 | prefLabel | ef:agent/consensus_match | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v10 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v11 |
| ef:activity/change/20260822T0600486828500000/259262 | altLabel | ef:agent/consensus_match | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v11 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v12 |
| ef:activity/change/20260822T0600486828500000/259263 | altLabel | ef:agent/consensus_match | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v12 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v13 |
| ef:activity/change/20260822T0600486828500000/259264 | cas_match_labels | ef:agent/consensus_match | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v13 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v14 |
| ef:activity/change/20260822T0600486828500000/278880 | properties | ef:agent/opsin_iupac | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v14 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v15 |
| ef:activity/change/20260822T0600486828500000/285685 | properties | ef:agent/rdkit_post_consensus | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v15 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v16 |
| ef:activity/change/20260822T0600486828500000/291254 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v16 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v17 |
| ef:activity/change/20260822T0600486828500000/324087 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v17 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v18 |
| ef:activity/change/20260822T0600486828500000/393257 | properties | ef:agent/normalise_property_values | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v18 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v19 |
| ef:activity/change/20260822T0600486828500000/402132 | types | ef:agent/link_flows_to_their_substance | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v19 | ef:flow/4bb2a74c-3350-4d67-8afe-f62cb8774282/v20 |