1-aminopropan-2-ol
Everything that changed this flow. Back to the flow
f600eb98-2208-49d2-90e5-af8c8a376465
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 |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 3188' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-aminopropan-2-ol||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'78-96-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-58cd135012c72d97: {'78-96-6': '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=['78-96-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_19030']; candidate_pubchem_cids=[4, 160870, 439938, 446260, 7311735, 7311736]; selected_pubchem_cids=[4]; 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 |
|---|---|---|---|---|---|
| 5,740 | bootstrap_labels | prefLabel | — | [{"@value":"1-aminopropan-2-ol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 5,741 | bootstrap_labels | name | 1-aminopropan-2-ol | — | Purged legacy name field to enforce prefLabel usage |
| 5,742 | bootstrap_labels | synonyms | ["(+/-)-1-Amino-2-propanol","(+/-)-Isopropanolamine","(R)-(-)-1-Aminopropan-2-ol","(R)-1-aminopropan-2-ol","(RS)-1-Amin… | [] | Removed legacy synonyms field in favor of structured labels |
| 197,634 | 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 |
| 197,635 | 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 |
| 215,256 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,705 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,706 | enrich_references | skos_definition | — | [{"@value":"Any amino alcohol that is propan-2-ol substituted by an amino group at position 1.","@language":"en","prove… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,707 | enrich_references | references | [] | [{"@id":"ecmdb:ECMDB04013","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['78-96-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_19030']; candidate_pubchem_cids=[4, 160870, 439938, 446260, 7311735, 7311736]; selected_pubchem_cids=[4]; 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 |
| 249,907 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | rdkit_pre_consensus from 'CC(CN)O'; added: monoisotopic_mass |
| 255,101 | chebi_altlabels | altLabel | [] | [{"@value":"1-methyl-2-aminoethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 258,969 | consensus_match | altLabel | [{"@value":"1-methyl-2-aminoethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | [{"@value":"1-methyl-2-aminoethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | group_key=1-aminopropan-2-ol||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=78-96-6; added Common Chemistry CAS names as altLabel: (2-Hydroxy-2-methylethyl)amine, (<em>RS</em>)-1-Amino-2-hydroxypropane, (<em>RS</em>)-1-amino-2-propanol, (±)-1-Amino-2-propanol, 1-Amino-2-hydroxypropane, 1-Amino-2-propanol, 1-Aminoisopropanol, 2-Amino-1-methylethanol, 2-Hydroxy-1-propanamine, 2-Hydroxy-1-propylamine, 2-Hydroxypropanamine, 2-Propanol, 1-amino-, <em>dl</em>-1-Amino-2-propanol, Additive CA, MIPA, NSC 3188, Threamine, α-Aminoisopropyl alcohol, β-Aminoisopropanol; object_uuid=fo-58cd135012c72d97 |
| 258,970 | consensus_match | cas_match_labels | — | {"78-96-6":"exactMatch"} | group_key=1-aminopropan-2-ol||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'78-96-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-58cd135012c72d97: {'78-96-6': 'exactMatch'} |
| 275,042 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-aminopropan-2-ol' |
| 281,528 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | rdkit_post_consensus from 'CC(O)CN'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,417 | strip_catalogue_altlabels | altLabel | [{"@value":"1-methyl-2-aminoethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | [{"@value":"1-methyl-2-aminoethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | Removed 1 catalogue altLabel value(s): 'NSC 3188' (registry code) |
| 379,844 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f600eb98-2208-… | associations resolved on the elementary layer |
| 389,343 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H9NO"],"… | typed the way the ontology types it |
| 396,448 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260820T1812399309960000/5740 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v0 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v1 |
| ef:activity/change/20260820T1812399309960000/5741 | name | ef:agent/bootstrap_labels | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v1 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v2 |
| ef:activity/change/20260820T1812399309960000/5742 | synonyms | ef:agent/bootstrap_labels | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v2 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v3 |
| ef:activity/change/20260820T1812399309960000/197634 | context | ef:agent/default_context_mapping | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v3 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v4 |
| ef:activity/change/20260820T1812399309960000/197635 | context_iri | ef:agent/default_context_mapping | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v4 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v5 |
| ef:activity/change/20260820T1812399309960000/215256 | unit_iri | ef:agent/unit_normalization | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v5 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v6 |
| ef:activity/change/20260820T1812399309960000/232705 | properties | ef:agent/enrich_references | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v6 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v7 |
| ef:activity/change/20260820T1812399309960000/232706 | skos_definition | ef:agent/enrich_references | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v7 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v8 |
| ef:activity/change/20260820T1812399309960000/232707 | references | ef:agent/enrich_references | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v8 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v9 |
| ef:activity/change/20260820T1812399309960000/249907 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v9 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v10 |
| ef:activity/change/20260820T1812399309960000/255101 | altLabel | ef:agent/chebi_altlabels | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v10 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v11 |
| ef:activity/change/20260820T1812399309960000/258969 | altLabel | ef:agent/consensus_match | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v11 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v12 |
| ef:activity/change/20260820T1812399309960000/258970 | cas_match_labels | ef:agent/consensus_match | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v12 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v13 |
| ef:activity/change/20260820T1812399309960000/275042 | properties | ef:agent/opsin_iupac | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v13 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v14 |
| ef:activity/change/20260820T1812399309960000/281528 | properties | ef:agent/rdkit_post_consensus | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v14 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v15 |
| ef:activity/change/20260820T1812399309960000/288417 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v15 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v16 |
| ef:activity/change/20260820T1812399309960000/379844 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v16 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v17 |
| ef:activity/change/20260820T1812399309960000/389343 | properties | ef:agent/normalise_property_values | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v17 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v18 |
| ef:activity/change/20260820T1812399309960000/396448 | types | ef:agent/link_flows_to_their_substance | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v18 | ef:flow/f600eb98-2208-49d2-90e5-af8c8a376465/v19 |