Sodium Hydrogen (1-hydroxy-1-phosphonoethyl)phosphonate
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-5b268400a7c8861d
Changes
55| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,528 | bootstrap_labels | prefLabel | — | [{"@value":"sodium hydrogen (1-hydroxy-1-phosphonoethyl)phosphonate","@language":"en","source":{"prov:wasGeneratedBy":"… | Bootstrapped prefLabel from legacy name field |
| 5,529 | bootstrap_labels | name | sodium hydrogen (1-hydroxy-1-phosphonoethyl)phosphonate | — | Purged legacy name field to enforce prefLabel usage |
| 5,530 | bootstrap_labels | synonyms | ["organic","(1-hydroxyethylidene)bisphosphonicacid,sodiumsalt","airquestc","aquacid1054ex","briquestadpa-20as","briques… | [] | Removed legacy synonyms field in favor of structured labels |
| 30,786 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 30,787 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 47,306 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 47,307 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 60,572 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 60,573 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 72,734 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 72,735 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 73,520 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 73,521 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 75,732 | 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 |
| 75,733 | 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 |
| 97,772 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 97,773 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 114,106 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 114,107 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 143,162 | 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 |
| 143,163 | 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 |
| 172,440 | 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 |
| 172,441 | 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 |
| 196,084 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 196,085 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 197,046 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 197,047 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 201,646 | 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) |
| 201,647 | 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) |
| 215,185 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,376 | normalize_name_case | prefLabel | [{"@value":"sodium hydrogen (1-hydroxy-1-phosphonoethyl)phosphonate","@language":"en","source":{"prov:wasGeneratedBy":"… | [{"@value":"Sodium Hydrogen (1-hydroxy-1-phosphonoethyl)phosphonate","@language":"en","source":{"prov:wasGeneratedBy":"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,495 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,496 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,497 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.045.040","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['29329-71-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[19629, 23894, 6335946, 23338401, 23687324, 57371113]; selected_pubchem_cids=[6335946]; 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 |
| 249,843 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | rdkit_pre_consensus from 'CC(O)(P(=O)(O)O)P(=O)(O)O.[Na]'; added: molecular_mass, monoisotopic_mass |
| 271,921 | consensus_match | altLabel | [] | [{"@value":"1-Hydroxyethane-1,1-diphosphonic acid sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consen… | group_key=sodiumhydrogen(1-hydroxy-1-phosphonoethyl)phosphonate||dimension=Environmental > media=Air > strata=Long-term; cas=29329-71-3; added Common Chemistry CAS names as altLabel: 1-Hydroxyethane-1,1-diphosphonic acid sodium salt, 1-Hydroxyethylidene-1,1-diphosphonic acid sodium salt, 1-Hydroxyethylidenediphosphonic acid sodium salt, Briquest ADPA 60SH, Cublen K 8514GR, HEDP sodium salt, Hydroxyethane-1,1-diphosphonic acid sodium salt, Phosphonic acid, (1-hydroxyethylidene)bis-, sodium salt, Phosphonic acid, (1-hydroxyethylidene)di-, sodium salt, Phosphonic acid, <em>P</em>,<em>P</em>′-(1-hydroxyethylidene)bis-, sodium salt (1:?), Sodium 1-hydroxyethane-1,1-diphosphonate; object_uuid=fo-5b268400a7c8861d |
| 271,922 | consensus_match | cas_match_labels | — | {"29329-71-3":"exactMatch"} | group_key=sodiumhydrogen(1-hydroxy-1-phosphonoethyl)phosphonate||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory']; cas_sources={'29329-71-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-5b268400a7c8861d: {'29329-71-3': 'exactMatch'} |
| 274,982 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-Hydroxyethane-1,1-diphosphonic acid sodium salt' |
| 281,466 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H8NaO7P2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4Na4O7P… | rdkit_post_consensus from 'CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,832 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4Na4O7P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C2H4Na4O7P… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 292,271 | dedupe_altlabels | altLabel | [{"@value":"1-Hydroxyethane-1,1-diphosphonic acid sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consen… | [{"@value":"1-Hydroxyethane-1,1-diphosphonic acid sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consen… | Deduplicated altLabel values and removed entries matching prefLabel |
| 296,432 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/06c9a5f7-9221-… | associations resolved on the elementary layer |
| 304,680 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/10d52fdf-46f9-… | associations resolved on the elementary layer |
| 311,305 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2415598b-9d70-… | associations resolved on the elementary layer |
| 317,384 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/35faf467-b351-… | associations resolved on the elementary layer |
| 317,776 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/37664e40-bf38-… | associations resolved on the elementary layer |
| 318,881 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3b1e5c62-5ab3-… | associations resolved on the elementary layer |
| 329,883 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/507edff3-12ed-… | associations resolved on the elementary layer |
| 338,052 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6bfbebeb-5f61-… | associations resolved on the elementary layer |
| 352,583 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9cf5906f-91bf-… | associations resolved on the elementary layer |