(3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide
Everything that changed this flow. Back to the flow
661b34aa-6752-424b-9b6b-5d291b1cb84f
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=(3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide||dimension=Environmental > media=Air > indoor=Unknown; group_sources=[]; cas_sources={'136465-81-1': []}; assigned CAS labels from group consensus; object_uuid=fo-9d015a6657a8bae7: {'136465-81-1': '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 soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 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=['136465-81-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[454736, 688323, 688344, 2733647, 3667935, 6541374, 7157270, 57364831, 123134381, 175647554]; selected_pubchem_cids=[454736]; 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 |
|---|---|---|---|---|---|
| 14,691 | bootstrap_labels | prefLabel | — | [{"@value":"(3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide","@language":"en","source":{"prov:wasGeneratedBy… | Bootstrapped prefLabel from legacy name field |
| 14,692 | bootstrap_labels | name | (3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide | — | Purged legacy name field to enforce prefLabel usage |
| 14,693 | bootstrap_labels | synonyms | ["organic","(3s,4as,8as)-n-tert-butyldecahydro-3-isoquinolinecarboxamide","phiq"] | [] | Removed legacy synonyms field in favor of structured labels |
| 110,624 | 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 |
| 110,625 | 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 |
| 218,189 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,084 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,085 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,086 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.285.972D","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['136465-81-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[454736, 688323, 688344, 2733647, 3667935, 6541374, 7157270, 57364831, 123134381, 175647554]; selected_pubchem_cids=[454736]; 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 |
| 252,325 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | rdkit_pre_consensus from 'CC(C)(C)NC(=O)C1CC2CCCCC2CN1'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 257,747 | consensus_match | altLabel | [] | [{"@value":"(3<em>S</em>,4a<em>S</em>,8a<em>S</em>)-<em>N</em>-(1,1-Dimethylethyl)decahydro-3-isoquinolinecarboxamide",… | group_key=(3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide||dimension=Environmental > media=Air > indoor=Unknown; cas=136465-81-1; added Common Chemistry CAS names as altLabel: (3<em>S</em>,4a<em>S</em>,8a<em>S</em>)-<em>N</em>-(1,1-Dimethylethyl)decahydro-3-isoquinolinecarboxamide, (3<em>S</em>,4a<em>S</em>,8a<em>S</em>)-Decahydroisoquinoline-3-carboxylic acid <em>tert</em>-butylamide, (<em>S</em>,<em>S</em>,<em>S</em>)-<em>N</em>-<em>tert</em>-Butyldecahydroisoquinoline-3-carboxamide, 3-Isoquinolinecarboxamide, <em>N</em>-(1,1-dimethylethyl)decahydro-, (3<em>S</em>,4a<em>S</em>,8a<em>S</em>)-, 3-Isoquinolinecarboxamide, <em>N</em>-(1,1-dimethylethyl)decahydro-, [3<em>S</em>-(3α,4aβ,8aβ)]-, [(3<em>S</em>)-(3α,4aβ,8aβ)]-<em>N</em>-(<em>tert</em>-Butyl)decahydro-3-isoquinolinecarboxamide; object_uuid=fo-9d015a6657a8bae7 |
| 257,748 | consensus_match | cas_match_labels | — | {"136465-81-1":"exactMatch"} | group_key=(3s,4as,8as)-ntertbutyldecahydroisoquinoline-3-carboxamide||dimension=Environmental > media=Air > indoor=Unknown; group_sources=[]; cas_sources={'136465-81-1': []}; assigned CAS labels from group consensus; object_uuid=fo-9d015a6657a8bae7: {'136465-81-1': 'exactMatch'} |
| 277,536 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(3S,4aS,8aS)-N-(1,1-Dimethylethyl)decahydro-3-isoquinolinecarboxamide' |
| 284,225 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | rdkit_post_consensus from 'CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,794 | dedupe_altlabels | altLabel | [{"@value":"(3<em>S</em>,4a<em>S</em>,8a<em>S</em>)-<em>N</em>-(1,1-Dimethylethyl)decahydro-3-isoquinolinecarboxamide",… | [{"@value":"(3S,4aS,8aS)-N-(1,1-Dimethylethyl)decahydro-3-isoquinolinecarboxamide","@language":"en","source":{"prov:was… | Deduplicated altLabel values and removed entries matching prefLabel |
| 336,331 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/661b34aa-6752-… | associations resolved on the elementary layer |
| 391,892 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | typed the way the ontology types it |
| 400,117 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 400,118 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C14H26N2O"… | 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/20260820T0738569779880000/14691 | prefLabel | ef:agent/bootstrap_labels | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v0 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v1 |
| ef:activity/change/20260820T0738569779880000/14692 | name | ef:agent/bootstrap_labels | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v1 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v2 |
| ef:activity/change/20260820T0738569779880000/14693 | synonyms | ef:agent/bootstrap_labels | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v2 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v3 |
| ef:activity/change/20260820T0738569779880000/110624 | context | ef:agent/default_context_mapping | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v3 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v4 |
| ef:activity/change/20260820T0738569779880000/110625 | context_iri | ef:agent/default_context_mapping | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v4 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v5 |
| ef:activity/change/20260820T0738569779880000/218189 | unit_iri | ef:agent/unit_normalization | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v5 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v6 |
| ef:activity/change/20260820T0738569779880000/241084 | properties | ef:agent/enrich_references | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v6 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v7 |
| ef:activity/change/20260820T0738569779880000/241085 | skos_definition | ef:agent/enrich_references | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v7 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v8 |
| ef:activity/change/20260820T0738569779880000/241086 | references | ef:agent/enrich_references | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v8 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v9 |
| ef:activity/change/20260820T0738569779880000/252325 | properties | ef:agent/rdkit_pre_consensus | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v9 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v10 |
| ef:activity/change/20260820T0738569779880000/257747 | altLabel | ef:agent/consensus_match | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v10 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v11 |
| ef:activity/change/20260820T0738569779880000/257748 | cas_match_labels | ef:agent/consensus_match | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v11 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v12 |
| ef:activity/change/20260820T0738569779880000/277536 | properties | ef:agent/opsin_iupac | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v12 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v13 |
| ef:activity/change/20260820T0738569779880000/284225 | properties | ef:agent/rdkit_post_consensus | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v13 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v14 |
| ef:activity/change/20260820T0738569779880000/292794 | altLabel | ef:agent/dedupe_altlabels | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v14 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v15 |
| ef:activity/change/20260820T0738569779880000/336331 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v15 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v16 |
| ef:activity/change/20260820T0738569779880000/391892 | properties | ef:agent/normalise_property_values | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v16 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v17 |
| ef:activity/change/20260820T0738569779880000/400117 | types | ef:agent/link_flows_to_their_substance | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v17 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v18 |
| ef:activity/change/20260820T0738569779880000/400118 | properties | ef:agent/link_flows_to_their_substance | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v18 | ef:flow/661b34aa-6752-424b-9b6b-5d291b1cb84f/v19 |