Amantadine hydrochloride
Everything that changed this flow. Back to the flow
b2c8dbff-6d49-4c28-87c2-49b524239f0e
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'ADS 5102' (grade code), 'NSC 83653' (registry code) |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=665-66-7; cc_chebi_agreed_name='Amantadine hydrochloride'; object_uuid=fo-20f0ca75f8f9eca3 |
| cas_match_labels | 1 | consensus_match | group_key=adamantan-1-aminehydrochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'665-66-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-20f0ca75f8f9eca3: {'665-66-7': '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 air > Emissions to non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['665-66-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_2619']; candidate_pubchem_cids=[2130, 3017, 64150, 517422, 19031614, 73557508]; selected_pubchem_cids=[517422]; 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
22| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,037 | bootstrap_labels | prefLabel | — | [{"@value":"adamantan-1-amine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 2,038 | bootstrap_labels | name | adamantan-1-amine hydrochloride | — | Purged legacy name field to enforce prefLabel usage |
| 2,039 | bootstrap_labels | synonyms | ["organic","amantadinehydrochloride"] | [] | Removed legacy synonyms field in favor of structured labels |
| 156,042 | 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 |
| 156,043 | 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 |
| 214,018 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,562 | normalize_name_case | prefLabel | [{"@value":"adamantan-1-amine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | [{"@value":"Adamantan-1-amine Hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,139 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 229,140 | enrich_references | skos_definition | — | [{"@value":"A hydrochloride obtained by combining amantadine and hydrochloric acid in equimolar amounts.","@language":"… | Merged ChEBI/PubChem definitions into skos:definition |
| 229,141 | enrich_references | references | [] | [{"@id":"gmelin:838463","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"con… | Added references with provenance; cas_numbers=['665-66-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_2619']; candidate_pubchem_cids=[2130, 3017, 64150, 517422, 19031614, 73557508]; selected_pubchem_cids=[517422]; 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 |
| 248,881 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | rdkit_pre_consensus from 'C1C2CC3CC1CC(C2)(C3)[NH3+].[Cl-]'; added: monoisotopic_mass |
| 254,611 | chebi_altlabels | altLabel | [] | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Added 8 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 263,563 | consensus_match | prefLabel | [{"@value":"Adamantan-1-amine Hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | [{"@value":"Amantadine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | cas=665-66-7; cc_chebi_agreed_name='Amantadine hydrochloride'; object_uuid=fo-20f0ca75f8f9eca3 |
| 263,564 | consensus_match | altLabel | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | cas=665-66-7; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-20f0ca75f8f9eca3 |
| 263,565 | consensus_match | altLabel | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | group_key=adamantan-1-aminehydrochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=665-66-7; added Common Chemistry CAS names as altLabel: 1-Adamantamine hydrochloride, 1-Adamantanamine, hydrochloride, ADS 5102, Adamantanamine hydrochloride, Adamantylamine hydrochloride, Adamin, Adamine, Amazolon, Aminoadamantane hydrochloride, EXP 105-1, Gocovri, Mantadan, Mantadine, Mantadix, Midantan, Midantane, Mydantane, NSC 83653, Symadine, Tricyclo[3.3.1.1<sup>3,7</sup>]decan-1-amine, hydrochloride, Tricyclo[3.3.1.1<sup>3,7</sup>]decan-1-amine, hydrochloride (1:1), Virasol, Virofral; object_uuid=fo-20f0ca75f8f9eca3 |
| 263,566 | consensus_match | cas_match_labels | — | {"665-66-7":"exactMatch"} | group_key=adamantan-1-aminehydrochloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'665-66-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-20f0ca75f8f9eca3: {'665-66-7': 'exactMatch'} |
| 274,002 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-Adamantanamine hydrochloride' |
| 280,406 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | rdkit_post_consensus from 'Cl.NC12CC3CC(CC(C3)C1)C2'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,660 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | [{"@value":"1-Adamantanamine hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wa… | Removed 2 catalogue altLabel value(s): 'ADS 5102' (grade code), 'NSC 83653' (registry code) |
| 359,045 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b2c8dbff-6d49-… | associations resolved on the elementary layer |
| 388,293 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18ClN"… | typed the way the ontology types it |
| 394,960 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | the substance's answer, copied onto its flow |
PROV-O trail
22 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/20260821T1554374006150000/2037 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v0 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v1 |
| ef:activity/change/20260821T1554374006150000/2038 | name | ef:agent/bootstrap_labels | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v1 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v2 |
| ef:activity/change/20260821T1554374006150000/2039 | synonyms | ef:agent/bootstrap_labels | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v2 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v3 |
| ef:activity/change/20260821T1554374006150000/156042 | context | ef:agent/default_context_mapping | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v3 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v4 |
| ef:activity/change/20260821T1554374006150000/156043 | context_iri | ef:agent/default_context_mapping | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v4 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v5 |
| ef:activity/change/20260821T1554374006150000/214018 | unit_iri | ef:agent/unit_normalization | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v5 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v6 |
| ef:activity/change/20260821T1554374006150000/221562 | prefLabel | ef:agent/normalize_name_case | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v6 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v7 |
| ef:activity/change/20260821T1554374006150000/229139 | properties | ef:agent/enrich_references | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v7 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v8 |
| ef:activity/change/20260821T1554374006150000/229140 | skos_definition | ef:agent/enrich_references | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v8 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v9 |
| ef:activity/change/20260821T1554374006150000/229141 | references | ef:agent/enrich_references | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v9 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v10 |
| ef:activity/change/20260821T1554374006150000/248881 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v10 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v11 |
| ef:activity/change/20260821T1554374006150000/254611 | altLabel | ef:agent/chebi_altlabels | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v11 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v12 |
| ef:activity/change/20260821T1554374006150000/263563 | prefLabel | ef:agent/consensus_match | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v12 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v13 |
| ef:activity/change/20260821T1554374006150000/263564 | altLabel | ef:agent/consensus_match | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v13 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v14 |
| ef:activity/change/20260821T1554374006150000/263565 | altLabel | ef:agent/consensus_match | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v14 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v15 |
| ef:activity/change/20260821T1554374006150000/263566 | cas_match_labels | ef:agent/consensus_match | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v15 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v16 |
| ef:activity/change/20260821T1554374006150000/274002 | properties | ef:agent/opsin_iupac | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v16 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v17 |
| ef:activity/change/20260821T1554374006150000/280406 | properties | ef:agent/rdkit_post_consensus | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v17 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v18 |
| ef:activity/change/20260821T1554374006150000/287660 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v18 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v19 |
| ef:activity/change/20260821T1554374006150000/359045 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v19 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v20 |
| ef:activity/change/20260821T1554374006150000/388293 | properties | ef:agent/normalise_property_values | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v20 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v21 |
| ef:activity/change/20260821T1554374006150000/394960 | types | ef:agent/link_flows_to_their_substance | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v21 | ef:flow/b2c8dbff-6d49-4c28-87c2-49b524239f0e/v22 |