Sodium Hydrogen {[bis(phosphonomethyl)amino]methyl}phosphonate
Everything that changed this flow. Back to the flow
0e6c5e96-352b-46de-b13f-2db7ff688ea3
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'A 2802N' (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=sodiumhydrogen{[bis(phosphonomethyl)amino]methyl}phosphonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'20592-85-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-214270738a5647b8: {'20592-85-2': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['20592-85-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[16698, 20063601, 23687322, 57376607, 122130064, 129893758, 166731226]; selected_pubchem_cids=[166731226]; 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 |
|---|---|---|---|---|---|
| 12,054 | bootstrap_labels | prefLabel | — | [{"@value":"sodium hydrogen {[bis(phosphonomethyl)amino]methyl}phosphonate","@language":"en","source":{"prov:wasGenerat… | Bootstrapped prefLabel from legacy name field |
| 12,055 | bootstrap_labels | name | sodium hydrogen {[bis(phosphonomethyl)amino]methyl}phosphonate | — | Purged legacy name field to enforce prefLabel usage |
| 12,056 | bootstrap_labels | synonyms | ["organic","[nitrilotris(methylene)]trisphosphonicacid,sodiumsalt","aminotris(methylenephosphonicacid),sodiumsalt","atm… | [] | Removed legacy synonyms field in favor of structured labels |
| 45,868 | 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 |
| 45,869 | 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 |
| 217,331 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,886 | normalize_name_case | prefLabel | [{"@value":"sodium hydrogen {[bis(phosphonomethyl)amino]methyl}phosphonate","@language":"en","source":{"prov:wasGenerat… | [{"@value":"Sodium Hydrogen {[bis(phosphonomethyl)amino]methyl}phosphonate","@language":"en","source":{"prov:wasGenerat… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,635 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 238,636 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,637 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=15505-05-2","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['20592-85-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[16698, 20063601, 23687322, 57376607, 122130064, 129893758, 166731226]; selected_pubchem_cids=[166731226]; 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 |
| 251,608 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | rdkit_pre_consensus from 'C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O.[Na]'; added: molecular_mass, monoisotopic_mass |
| 271,935 | consensus_match | altLabel | [] | [{"@value":"A 2802N","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | group_key=sodiumhydrogen{[bis(phosphonomethyl)amino]methyl}phosphonate||dimension=Environmental > media=Water > water_body=Ocean; cas=20592-85-2; added Common Chemistry CAS names as altLabel: A 2802N, Amino(trimethylenephosphonic acid) sodium salt, Briquest 301 Low AM, Cublen A 4015, Korilat, Nitrilotri(methylenephosphonic acid) sodium salt, Phosphonic acid, <em>P</em>,<em>P</em>′,<em>P</em>′′-[nitrilotris(methylene)]tris-, sodium salt (1:?), Phosphonic acid, [nitrilotris(methylene)]tri-, sodium salt, Phosphonic acid, [nitrilotris(methylene)]tris-, sodium salt, Sequion 20Na38, Sodium aminotris(methylenephosphonate), Sodium nitrilotrimethylenephosphonate, Sodium[nitrilotris(methylene)]trisphosphonate, Tris(phosphonomethyl)amine sodium salt; object_uuid=fo-214270738a5647b8 |
| 271,936 | consensus_match | cas_match_labels | — | {"20592-85-2":"exactMatch"} | group_key=sodiumhydrogen{[bis(phosphonomethyl)amino]methyl}phosphonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'20592-85-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-214270738a5647b8: {'20592-85-2': 'exactMatch'} |
| 283,427 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | rdkit_post_consensus from 'C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O.[Na]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,733 | strip_catalogue_altlabels | altLabel | [{"@value":"A 2802N","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consens… | [{"@value":"Amino(trimethylenephosphonic acid) sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | Removed 1 catalogue altLabel value(s): 'A 2802N' (grade code) |
| 303,960 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0e6c5e96-352b-… | associations resolved on the elementary layer |
| 391,145 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H12NNaO9… | typed the way the ontology types it |
| 399,054 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | 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/20260821T1554374006150000/12054 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v0 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v1 |
| ef:activity/change/20260821T1554374006150000/12055 | name | ef:agent/bootstrap_labels | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v1 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v2 |
| ef:activity/change/20260821T1554374006150000/12056 | synonyms | ef:agent/bootstrap_labels | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v2 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v3 |
| ef:activity/change/20260821T1554374006150000/45868 | context | ef:agent/default_context_mapping | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v3 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v4 |
| ef:activity/change/20260821T1554374006150000/45869 | context_iri | ef:agent/default_context_mapping | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v4 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v5 |
| ef:activity/change/20260821T1554374006150000/217331 | unit_iri | ef:agent/unit_normalization | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v5 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v6 |
| ef:activity/change/20260821T1554374006150000/223886 | prefLabel | ef:agent/normalize_name_case | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v6 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v7 |
| ef:activity/change/20260821T1554374006150000/238635 | properties | ef:agent/enrich_references | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v7 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v8 |
| ef:activity/change/20260821T1554374006150000/238636 | skos_definition | ef:agent/enrich_references | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v8 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v9 |
| ef:activity/change/20260821T1554374006150000/238637 | references | ef:agent/enrich_references | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v9 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v10 |
| ef:activity/change/20260821T1554374006150000/251608 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v10 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v11 |
| ef:activity/change/20260821T1554374006150000/271935 | altLabel | ef:agent/consensus_match | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v11 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v12 |
| ef:activity/change/20260821T1554374006150000/271936 | cas_match_labels | ef:agent/consensus_match | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v12 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v13 |
| ef:activity/change/20260821T1554374006150000/283427 | properties | ef:agent/rdkit_post_consensus | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v13 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v14 |
| ef:activity/change/20260821T1554374006150000/289733 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v14 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v15 |
| ef:activity/change/20260821T1554374006150000/303960 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v15 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v16 |
| ef:activity/change/20260821T1554374006150000/391145 | properties | ef:agent/normalise_property_values | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v16 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v17 |
| ef:activity/change/20260821T1554374006150000/399054 | types | ef:agent/link_flows_to_their_substance | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v17 | ef:flow/0e6c5e96-352b-46de-b13f-2db7ff688ea3/v18 |