(4s)-4-(phenylsulfanyl)-l-proline
Everything that changed this flow. Back to the flow
4f669beb-5411-44dc-9dba-23439511e3e5
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=(4s)-4-(phenylsulfanyl)-l-proline||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'81653-77-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-919090bc4f97371c: {'81653-77-2': '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 fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 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=['81653-77-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[11379084, 54181826]; selected_pubchem_cids=[11379084]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 19,038 | bootstrap_labels | prefLabel | — | [{"@value":"(4s)-4-(phenylsulfanyl)-l-proline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","pro… | Bootstrapped prefLabel from legacy name field |
| 19,039 | bootstrap_labels | name | (4s)-4-(phenylsulfanyl)-l-proline | — | Purged legacy name field to enforce prefLabel usage |
| 19,040 | bootstrap_labels | synonyms | ["organic","l-proline,4-(phenylthio)-,(4s)-othernamescis-4-phenylthio-l-proline"] | [] | Removed legacy synonyms field in favor of structured labels |
| 97,158 | 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 |
| 97,159 | 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 |
| 219,552 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 244,915 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,916 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,917 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J516.135E","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['81653-77-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[11379084, 54181826]; selected_pubchem_cids=[11379084]; 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 |
| 253,432 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | rdkit_pre_consensus from 'C1C(CNC1C(=O)O)SC2=CC=CC=C2'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 257,785 | consensus_match | altLabel | [] | [{"@value":"(2<em>S</em>,4<em>S</em>)-4-(Phenylthio)pyrrolidine-2-carboxylic acid","@language":"en","source":{"prov:was… | group_key=(4s)-4-(phenylsulfanyl)-l-proline||dimension=Environmental > media=Ground > geography=Agricultural; cas=81653-77-2; added Common Chemistry CAS names as altLabel: (2<em>S</em>,4<em>S</em>)-4-(Phenylthio)pyrrolidine-2-carboxylic acid, (4<em>S</em>)-4-(Phenylthio)-<span class="text-smallcaps">L</span>-proline, <em>cis</em>-4-(Phenylthio)-<span class="text-smallcaps">L</span>-proline, <span class="text-smallcaps">L</span>-Proline, 4-(phenylthio)-, (4<em>S</em>)-, <span class="text-smallcaps">L</span>-Proline, 4-(phenylthio)-, <em>cis</em>-; object_uuid=fo-919090bc4f97371c |
| 257,786 | consensus_match | cas_match_labels | — | {"81653-77-2":"exactMatch"} | group_key=(4s)-4-(phenylsulfanyl)-l-proline||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'81653-77-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-919090bc4f97371c: {'81653-77-2': 'exactMatch'} |
| 278,658 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(4s)-4-(phenylsulfanyl)-l-proline' |
| 285,436 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | rdkit_post_consensus from 'O=C(O)[C@@H]1C[C@H](Sc2ccccc2)CN1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,037 | dedupe_altlabels | altLabel | [{"@value":"(2<em>S</em>,4<em>S</em>)-4-(Phenylthio)pyrrolidine-2-carboxylic acid","@language":"en","source":{"prov:was… | [{"@value":"(2S,4S)-4-(Phenylthio)pyrrolidine-2-carboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"cons… | Deduplicated altLabel values and removed entries matching prefLabel |
| 329,596 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4f669beb-5411-… | associations resolved on the elementary layer |
| 393,025 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | typed the way the ontology types it |
| 401,771 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 401,772 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H13NO2S… | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260820T0738569779880000/19038 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v0 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v1 |
| ef:activity/change/20260820T0738569779880000/19039 | name | ef:agent/bootstrap_labels | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v1 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v2 |
| ef:activity/change/20260820T0738569779880000/19040 | synonyms | ef:agent/bootstrap_labels | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v2 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v3 |
| ef:activity/change/20260820T0738569779880000/97158 | context | ef:agent/default_context_mapping | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v3 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v4 |
| ef:activity/change/20260820T0738569779880000/97159 | context_iri | ef:agent/default_context_mapping | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v4 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v5 |
| ef:activity/change/20260820T0738569779880000/219552 | unit_iri | ef:agent/unit_normalization | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v5 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v6 |
| ef:activity/change/20260820T0738569779880000/244915 | properties | ef:agent/enrich_references | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v6 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v7 |
| ef:activity/change/20260820T0738569779880000/244916 | skos_definition | ef:agent/enrich_references | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v7 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v8 |
| ef:activity/change/20260820T0738569779880000/244917 | references | ef:agent/enrich_references | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v8 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v9 |
| ef:activity/change/20260820T0738569779880000/253432 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v9 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v10 |
| ef:activity/change/20260820T0738569779880000/257785 | altLabel | ef:agent/consensus_match | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v10 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v11 |
| ef:activity/change/20260820T0738569779880000/257786 | cas_match_labels | ef:agent/consensus_match | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v11 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v12 |
| ef:activity/change/20260820T0738569779880000/278658 | properties | ef:agent/opsin_iupac | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v12 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v13 |
| ef:activity/change/20260820T0738569779880000/285436 | properties | ef:agent/rdkit_post_consensus | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v13 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v14 |
| ef:activity/change/20260820T0738569779880000/293037 | altLabel | ef:agent/dedupe_altlabels | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v14 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v15 |
| ef:activity/change/20260820T0738569779880000/329596 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v15 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v16 |
| ef:activity/change/20260820T0738569779880000/393025 | properties | ef:agent/normalise_property_values | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v16 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v17 |
| ef:activity/change/20260820T0738569779880000/401771 | types | ef:agent/link_flows_to_their_substance | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v17 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v18 |
| ef:activity/change/20260820T0738569779880000/401772 | properties | ef:agent/link_flows_to_their_substance | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v18 | ef:flow/4f669beb-5411-44dc-9dba-23439511e3e5/v19 |