2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate
Everything that changed this flow. Back to the flow
280059d4-6bd3-4c74-9357-1d8f63c10738
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 2 catalogue altLabel value(s): 'M 2005' (grade code), 'PC 2118' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'67881-98-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c7dc6dbb86a14893: {'67881-98-5': '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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 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=['67881-98-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[69562, 128934, 128935, 57352570]; selected_pubchem_cids=[128934]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 230 | bootstrap_labels | prefLabel | — | [{"@value":"2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate","@language":"en","source":{"prov:wasGenera… | Bootstrapped prefLabel from legacy name field |
| 231 | bootstrap_labels | name | 2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate | — | Purged legacy name field to enforce prefLabel usage |
| 232 | bootstrap_labels | synonyms | ["hema-pc","bm-1001","lipidure-pc","mpc","pcmonomer","2-(methacryloxy)alkyl2-(trimethylammonio)alkylphosphate","2-(meth… | [] | Removed legacy synonyms field in favor of structured labels |
| 62,788 | 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 |
| 62,789 | 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 |
| 213,415 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 227,388 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,389 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,390 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J532.632J","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['67881-98-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[69562, 128934, 128935, 57352570]; selected_pubchem_cids=[128934]; 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 |
| 248,375 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | rdkit_pre_consensus from 'CC(=C)C(=O)OCCOP(=O)([O-])OCC[N+](C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 260,372 | consensus_match | altLabel | [] | [{"@value":"2-(2-Methylprop-2-enoyloxy)ethyl 2-(trimethylazaniumyl)ethyl phosphate","@language":"en","source":{"prov:wa… | group_key=2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate||dimension=Environmental > media=Water > water_body=Unknown; cas=67881-98-5; added Common Chemistry CAS names as altLabel: 2-(2-Methylprop-2-enoyloxy)ethyl 2-(trimethylazaniumyl)ethyl phosphate, 2-(Methacryloyloxy)ethyl 2-(trimethylammonio)ethyl phosphate, 2-(Methacryloyloxy)ethyl 2′-(trimethylammonio)ethyl phosphate, 2-Methacryloyloxyethyl phosphatidylcholine, 2-Methacryloyloxyethyl phosphoryl choline, 2-Methacryloyloxyethyl phosphorylcholine, 2-Methylacryloyloxyethyl phosphorylcholine, 3,5,8-Trioxa-4-phosphaundec-10-en-1-aminium, 4-hydroxy-<em>N</em>,<em>N</em>,<em>N</em>,10-tetramethyl-9-oxo-, inner salt, 4-oxide, M 2005, MPC, PC 2118; object_uuid=fo-c7dc6dbb86a14893 |
| 260,373 | consensus_match | cas_match_labels | — | {"67881-98-5":"exactMatch"} | group_key=2-(methacryloyloxyethyl)-2'-((trimethylammonium)ethyl)phosphate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'67881-98-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c7dc6dbb86a14893: {'67881-98-5': 'exactMatch'} |
| 279,871 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | rdkit_post_consensus from 'CC(=C)C(=O)OCCOP(=O)([O-])OCC[N+](C)(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,315 | strip_catalogue_altlabels | altLabel | [{"@value":"2-(2-Methylprop-2-enoyloxy)ethyl 2-(trimethylazaniumyl)ethyl phosphate","@language":"en","source":{"prov:wa… | [{"@value":"2-(2-Methylprop-2-enoyloxy)ethyl 2-(trimethylazaniumyl)ethyl phosphate","@language":"en","source":{"prov:wa… | Removed 2 catalogue altLabel value(s): 'M 2005' (grade code), 'PC 2118' (grade code) |
| 312,432 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/280059d4-6bd3-… | associations resolved on the elementary layer |
| 387,796 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H22NO6P… | typed the way the ontology types it |
| 394,274 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/Zwitterion"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260820T0738569779880000/230 | prefLabel | ef:agent/bootstrap_labels | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v0 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v1 |
| ef:activity/change/20260820T0738569779880000/231 | name | ef:agent/bootstrap_labels | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v1 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v2 |
| ef:activity/change/20260820T0738569779880000/232 | synonyms | ef:agent/bootstrap_labels | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v2 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v3 |
| ef:activity/change/20260820T0738569779880000/62788 | context | ef:agent/default_context_mapping | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v3 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v4 |
| ef:activity/change/20260820T0738569779880000/62789 | context_iri | ef:agent/default_context_mapping | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v4 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v5 |
| ef:activity/change/20260820T0738569779880000/213415 | unit_iri | ef:agent/unit_normalization | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v5 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v6 |
| ef:activity/change/20260820T0738569779880000/227388 | properties | ef:agent/enrich_references | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v6 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v7 |
| ef:activity/change/20260820T0738569779880000/227389 | skos_definition | ef:agent/enrich_references | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v7 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v8 |
| ef:activity/change/20260820T0738569779880000/227390 | references | ef:agent/enrich_references | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v8 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v9 |
| ef:activity/change/20260820T0738569779880000/248375 | properties | ef:agent/rdkit_pre_consensus | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v9 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v10 |
| ef:activity/change/20260820T0738569779880000/260372 | altLabel | ef:agent/consensus_match | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v10 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v11 |
| ef:activity/change/20260820T0738569779880000/260373 | cas_match_labels | ef:agent/consensus_match | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v11 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v12 |
| ef:activity/change/20260820T0738569779880000/279871 | properties | ef:agent/rdkit_post_consensus | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v12 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v13 |
| ef:activity/change/20260820T0738569779880000/287315 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v13 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v14 |
| ef:activity/change/20260820T0738569779880000/312432 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v14 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v15 |
| ef:activity/change/20260820T0738569779880000/387796 | properties | ef:agent/normalise_property_values | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v15 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v16 |
| ef:activity/change/20260820T0738569779880000/394274 | types | ef:agent/link_flows_to_their_substance | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v16 | ef:flow/280059d4-6bd3-4c74-9357-1d8f63c10738/v17 |