Methyl Trans-3-oxo-2-pentylcyclopentanecarboxylate
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-57d2778c7ea1b099
Changes
56| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,689 | bootstrap_labels | prefLabel | — | [{"@value":"methyl trans-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"boots… | Bootstrapped prefLabel from legacy name field |
| 2,690 | bootstrap_labels | name | methyl trans-3-oxo-2-pentylcyclopentanecarboxylate | — | Purged legacy name field to enforce prefLabel usage |
| 2,691 | bootstrap_labels | synonyms | ["organic","yasmolys"] | [] | Removed legacy synonyms field in favor of structured labels |
| 27,814 | 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 |
| 27,815 | 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 |
| 107,048 | 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) |
| 107,049 | 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) |
| 112,122 | 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 |
| 112,123 | 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 |
| 118,834 | 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 |
| 118,835 | 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 |
| 123,440 | 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) |
| 123,441 | 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) |
| 124,290 | 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 |
| 124,291 | 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 |
| 165,438 | 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 |
| 165,439 | 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 |
| 173,198 | 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 |
| 173,199 | 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 |
| 183,136 | 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 |
| 183,137 | 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 |
| 188,834 | 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 |
| 188,835 | 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 |
| 198,414 | 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 |
| 198,415 | 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 |
| 212,508 | 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 |
| 212,509 | 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 |
| 213,080 | 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 |
| 213,081 | 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 |
| 214,236 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,705 | normalize_name_case | prefLabel | [{"@value":"methyl trans-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"boots… | [{"@value":"Methyl Trans-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":"boots… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,767 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,768 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,769 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=1271488-66-4","provenance":{"prov:wasGeneratedBy":"enrich_refere… | Added references with provenance; cas_numbers=['1271488-66-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[165339425]; selected_pubchem_cids=[165339425]; 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 |
| 249,065 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | rdkit_pre_consensus from 'CCCCCC1C(CCC1=O)C(=O)OC'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 268,923 | consensus_match | altLabel | [] | [{"@value":"<em>rel</em>-Methyl (1<em>R</em>,2<em>S</em>)-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","sour… | group_key=methyltrans-3-oxo-2-pentylcyclopentanecarboxylate||dimension=Environmental > media=Water > water_body=Surface water; cas=1271488-66-4; added Common Chemistry CAS names as altLabel: <em>rel</em>-Methyl (1<em>R</em>,2<em>S</em>)-3-oxo-2-pentylcyclopentanecarboxylate, Cyclopentanecarboxylic acid, 3-oxo-2-pentyl-, methyl ester, (1<em>R</em>,2<em>S</em>)-<em>rel</em>-; object_uuid=fo-57d2778c7ea1b099 |
| 268,924 | consensus_match | cas_match_labels | — | {"1271488-66-4":"exactMatch"} | group_key=methyltrans-3-oxo-2-pentylcyclopentanecarboxylate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=[]; cas_sources={'1271488-66-4': []}; assigned CAS labels from group consensus; object_uuid=fo-57d2778c7ea1b099: {'1271488-66-4': 'exactMatch'} |
| 274,185 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Methyl Trans-3-oxo-2-pentylcyclopentanecarboxylate' |
| 280,605 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H20O3"]… | rdkit_post_consensus from 'CCCCC[C@@H]1C(=O)CC[C@H]1C(=O)OC'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,118 | dedupe_altlabels | altLabel | [{"@value":"<em>rel</em>-Methyl (1<em>R</em>,2<em>S</em>)-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","sour… | [{"@value":"rel-Methyl (1R,2S)-3-oxo-2-pentylcyclopentanecarboxylate","@language":"en","source":{"prov:wasGeneratedBy":… | Deduplicated altLabel values and removed entries matching prefLabel |
| 294,951 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0351e655-c0fb-… | associations resolved on the elementary layer |
| 334,522 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/60614df1-ef81-… | associations resolved on the elementary layer |
| 337,060 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/68a73ac9-1748-… | associations resolved on the elementary layer |
| 340,415 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/73eca1a0-a4b1-… | associations resolved on the elementary layer |
| 342,718 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7bff1a5e-1141-… | associations resolved on the elementary layer |
| 343,147 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7d28a93e-25f5-… | associations resolved on the elementary layer |
| 363,745 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c3507c74-f42f-… | associations resolved on the elementary layer |
| 367,623 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d04bbbd1-4635-… | associations resolved on the elementary layer |
| 372,595 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/dfdcf1ad-be34-… | associations resolved on the elementary layer |
| 375,445 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e8471910-6593-… | associations resolved on the elementary layer |