Methyl [(dimethoxyphosphinothioyl)thio]acetate
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-94b4-0050c2490048
By field
14 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 | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=methyl[(dimethoxyphosphinothioyl)thio]acetate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'757-86-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fa27e7344c638446: {'757-86-8': '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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 212-058-6 from CAS 757-86-8 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['757-86-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[69793, 242811, 57353444]; selected_pubchem_cids=[69793]; 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 |
|---|---|---|---|---|---|
| 7,768 | bootstrap_labels | prefLabel | — | [{"@value":"methyl [(dimethoxyphosphinothioyl)thio]acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Bootstrapped prefLabel from legacy name field |
| 7,769 | bootstrap_labels | name | methyl [(dimethoxyphosphinothioyl)thio]acetate | — | Purged legacy name field to enforce prefLabel usage |
| 7,770 | bootstrap_labels | synonyms | ["AC1L2COE","AC1Q44BB","AC1Q44BC","AC1Q603D","I14-14258","Methyl ((dimethoxyphosphinothioyl)thio)acetate","Methyl (Dime… | [] | Removed legacy synonyms field in favor of structured labels |
| 91,450 | 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 |
| 91,451 | 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 |
| 215,931 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,913 | normalize_name_case | prefLabel | [{"@value":"methyl [(dimethoxyphosphinothioyl)thio]acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | [{"@value":"Methyl [(dimethoxyphosphinothioyl)thio]acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,845 | ec_cross_check | ec_numbers | [] | ["212-058-6"] | Resolved from EC-inventory: 212-058-6 from CAS 757-86-8 |
| 234,615 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 234,616 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 234,617 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J47.254I","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['757-86-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[69793, 242811, 57353444]; selected_pubchem_cids=[69793]; 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 |
| 250,449 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | rdkit_pre_consensus from 'COC(=O)CSP(=S)(OC)OC'; added: molecular_mass, monoisotopic_mass |
| 268,791 | consensus_match | altLabel | [] | [{"@value":"<em>O</em>,<em>O</em>-Dimethyl <em>S</em>-(methoxycarbonylmethyl)phosphorodithioate","@language":"en","sour… | group_key=methyl[(dimethoxyphosphinothioyl)thio]acetate||dimension=Environmental > media=Water > water_body=Ocean; cas=757-86-8; added Common Chemistry CAS names as altLabel: <em>O</em>,<em>O</em>-Dimethyl <em>S</em>-(methoxycarbonylmethyl)phosphorodithioate, <em>O</em>,<em>O</em>-Dimethyl-<em>S</em>-(methoxycarbonylmethyl)dithiophosphate, <em>S</em>-[(Methoxycarbonyl)methyl] <em>O</em>,<em>O</em>-dimethyl phosphorodithioate, Acetic acid, 2-[(dimethoxyphosphinothioyl)thio]-, methyl ester, Acetic acid, [(dimethoxyphosphinothioyl)thio]-, methyl ester, Acetic acid, mercapto-, <em>S</em>-ester with <em>O</em>,<em>O</em>-dimethyl phosphorodithioate, methyl ester, Acetic acid, mercapto-, methyl ester, <em>O</em>,<em>O</em>-dimethyl phosphorodithioate, Acetic acid, mercapto-, methyl ester, <em>S</em>-ester with <em>O</em>,<em>O</em>-dimethyl phosphorodithioate, Dimethoic acid methyl ester, Phosphorodithioic acid, <em>O</em>,<em>O</em>-dimethyl ester, <em>S</em>-ester with methyl mercaptoacetate; object_uuid=fo-fa27e7344c638446 |
| 268,792 | consensus_match | cas_match_labels | — | {"757-86-8":"exactMatch"} | group_key=methyl[(dimethoxyphosphinothioyl)thio]acetate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'757-86-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fa27e7344c638446: {'757-86-8': 'exactMatch'} |
| 275,618 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Methyl [(dimethoxyphosphinothioyl)thio]acetate' |
| 282,152 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | rdkit_post_consensus from 'COC(=O)CSP(=S)(OC)OC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,370 | dedupe_altlabels | altLabel | [{"@value":"<em>O</em>,<em>O</em>-Dimethyl <em>S</em>-(methoxycarbonylmethyl)phosphorodithioate","@language":"en","sour… | [{"@value":"O,O-Dimethyl S-(methoxycarbonylmethyl)phosphorodithioate","@language":"en","source":{"prov:wasGeneratedBy":… | Deduplicated altLabel values and removed entries matching prefLabel |
| 326,731 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 389,940 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H11O4PS2… | typed the way the ontology types it |
| 397,337 | 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/20260822T0600486828500000/7768 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v1 |
| ef:activity/change/20260822T0600486828500000/7769 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v2 |
| ef:activity/change/20260822T0600486828500000/7770 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v3 |
| ef:activity/change/20260822T0600486828500000/91450 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v4 |
| ef:activity/change/20260822T0600486828500000/91451 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v5 |
| ef:activity/change/20260822T0600486828500000/215931 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v6 |
| ef:activity/change/20260822T0600486828500000/222913 | prefLabel | ef:agent/normalize_name_case | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v7 |
| ef:activity/change/20260822T0600486828500000/226845 | ec_numbers | ef:agent/ec_cross_check | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v8 |
| ef:activity/change/20260822T0600486828500000/234615 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v9 |
| ef:activity/change/20260822T0600486828500000/234616 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v10 |
| ef:activity/change/20260822T0600486828500000/234617 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v11 |
| ef:activity/change/20260822T0600486828500000/250449 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v12 |
| ef:activity/change/20260822T0600486828500000/268791 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v13 |
| ef:activity/change/20260822T0600486828500000/268792 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v14 |
| ef:activity/change/20260822T0600486828500000/275618 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v15 |
| ef:activity/change/20260822T0600486828500000/282152 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v16 |
| ef:activity/change/20260822T0600486828500000/292370 | altLabel | ef:agent/dedupe_altlabels | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v17 |
| ef:activity/change/20260822T0600486828500000/326731 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v18 |
| ef:activity/change/20260822T0600486828500000/389940 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v19 |
| ef:activity/change/20260822T0600486828500000/397337 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v19 | ef:flow/4d9a8790-3ddd-11dd-94b4-0050c2490048/v20 |