Reaction Mass Of (1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl Propanoate, (1r,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl Propanoate And (1r*,2'r*)-(2,6,6-trimethyl-1-cycloheptyloxycarbonyl)methyl Propanoate
Everything that changed this flow. Back to the flow
5e6c45d0-0830-463d-b640-1306d247a966
By field
13 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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=reactionmassof(1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoate,(1r,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoateand(1r*,2'r*)-(2,6,6-trimethyl-1-cycloheptyloxycarbonyl)methylpropanoate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=236391-76-7; added Common Chemistry CAS names as altLabel: 1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate, Acetic acid, (1-oxopropoxy)-, 1-(3,3-dimethylcyclohexyl)ethyl ester, Acetic acid, 2-(1-oxopropoxy)-, 1-(3,3-dimethylcyclohexyl)ethyl ester, Romandolide; object_uuid=fo-99a04b3ef962f0d6 |
| cas_match_labels | 1 | consensus_match | group_key=reactionmassof(1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoate,(1r,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoateand(1r*,2'r*)-(2,6,6-trimethyl-1-cycloheptyloxycarbonyl)methylpropanoate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'236391-76-7': []}; assigned CAS labels from group consensus; object_uuid=fo-99a04b3ef962f0d6: {'236391-76-7': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['236391-76-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[21933618]; selected_pubchem_cids=[21933618]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,519 | bootstrap_labels | prefLabel | — | [{"@value":"reaction mass of (1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl propanoate, (1r,1'r)-[1-(3… | Bootstrapped prefLabel from legacy name field |
| 2,520 | bootstrap_labels | name | reaction mass of (1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl propanoate, (1r,1'r)-[1-(3',3'-dimethy… | — | Purged legacy name field to enforce prefLabel usage |
| 2,521 | bootstrap_labels | synonyms | ["organic","aceticacid,2-(1-oxopropoxy)-,1-(3,3-dimethylcyclohexyl)ethylester","romandolide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 105,776 | 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 |
| 105,777 | 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 |
| 214,179 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,666 | normalize_name_case | prefLabel | [{"@value":"reaction mass of (1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl propanoate, (1r,1'r)-[1-(3… | [{"@value":"Reaction Mass Of (1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methyl Propanoate, (1r,1'r)-[1-(3… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,601 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,602 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,603 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.803.375A","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['236391-76-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[21933618]; selected_pubchem_cids=[21933618]; 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 |
| 249,014 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | rdkit_pre_consensus from 'CCC(=O)OCC(=O)OC(C)C1CCCC(C1)(C)C'; added: molecular_mass, monoisotopic_mass |
| 271,299 | consensus_match | altLabel | [] | [{"@value":"1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate","@language":"en","source":{"prov:wasGeneratedBy":"… | group_key=reactionmassof(1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoate,(1r,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoateand(1r*,2'r*)-(2,6,6-trimethyl-1-cycloheptyloxycarbonyl)methylpropanoate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=236391-76-7; added Common Chemistry CAS names as altLabel: 1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate, Acetic acid, (1-oxopropoxy)-, 1-(3,3-dimethylcyclohexyl)ethyl ester, Acetic acid, 2-(1-oxopropoxy)-, 1-(3,3-dimethylcyclohexyl)ethyl ester, Romandolide; object_uuid=fo-99a04b3ef962f0d6 |
| 271,300 | consensus_match | cas_match_labels | — | {"236391-76-7":"exactMatch"} | group_key=reactionmassof(1s,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoate,(1r,1'r)-[1-(3',3'-dimethyl-1'-cyclohexyl)ethoxycarbonyl]methylpropanoateand(1r*,2'r*)-(2,6,6-trimethyl-1-cycloheptyloxycarbonyl)methylpropanoate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'236391-76-7': []}; assigned CAS labels from group consensus; object_uuid=fo-99a04b3ef962f0d6: {'236391-76-7': 'exactMatch'} |
| 274,136 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate' |
| 280,553 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | rdkit_post_consensus from 'CCC(=O)OCC(=O)OC(C)C1CCCC(C)(C)C1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 333,886 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5e6c45d0-0830-… | associations resolved on the elementary layer |
| 388,428 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H26O4"]… | typed the way the ontology types it |
| 395,158 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1554374006150000/2519 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v0 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v1 |
| ef:activity/change/20260821T1554374006150000/2520 | name | ef:agent/bootstrap_labels | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v1 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v2 |
| ef:activity/change/20260821T1554374006150000/2521 | synonyms | ef:agent/bootstrap_labels | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v2 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v3 |
| ef:activity/change/20260821T1554374006150000/105776 | context | ef:agent/default_context_mapping | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v3 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v4 |
| ef:activity/change/20260821T1554374006150000/105777 | context_iri | ef:agent/default_context_mapping | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v4 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v5 |
| ef:activity/change/20260821T1554374006150000/214179 | unit_iri | ef:agent/unit_normalization | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v5 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v6 |
| ef:activity/change/20260821T1554374006150000/221666 | prefLabel | ef:agent/normalize_name_case | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v6 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v7 |
| ef:activity/change/20260821T1554374006150000/229601 | properties | ef:agent/enrich_references | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v7 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v8 |
| ef:activity/change/20260821T1554374006150000/229602 | skos_definition | ef:agent/enrich_references | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v8 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v9 |
| ef:activity/change/20260821T1554374006150000/229603 | references | ef:agent/enrich_references | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v9 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v10 |
| ef:activity/change/20260821T1554374006150000/249014 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v10 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v11 |
| ef:activity/change/20260821T1554374006150000/271299 | altLabel | ef:agent/consensus_match | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v11 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v12 |
| ef:activity/change/20260821T1554374006150000/271300 | cas_match_labels | ef:agent/consensus_match | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v12 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v13 |
| ef:activity/change/20260821T1554374006150000/274136 | properties | ef:agent/opsin_iupac | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v13 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v14 |
| ef:activity/change/20260821T1554374006150000/280553 | properties | ef:agent/rdkit_post_consensus | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v14 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v15 |
| ef:activity/change/20260821T1554374006150000/333886 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v15 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v16 |
| ef:activity/change/20260821T1554374006150000/388428 | properties | ef:agent/normalise_property_values | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v16 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v17 |
| ef:activity/change/20260821T1554374006150000/395158 | types | ef:agent/link_flows_to_their_substance | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v17 | ef:flow/5e6c45d0-0830-463d-b640-1306d247a966/v18 |