Changes

#	Step	Field	From	To	Why
19,893	bootstrap_labels	prefLabel	—	[{"@value":"Water (rain water)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed…	Bootstrapped prefLabel from legacy name field
19,894	bootstrap_labels	name	Water (rain water)	—	Purged legacy name field to enforce prefLabel usage
65,040	default_context_mapping	context	—	{"dimension":"Resource","media":"Water","water_body":"Unknown"}	Mapped from context mapping for source=EF 3.1, source context Resources > Resources from water > Renewable material resources from water
65,041	default_context_mapping	context_iri	—	https://vocab.brightway.one/flow-contexts/reso-wate	Mapped from context mapping for source=EF 3.1, source context Resources > Resources from water > Renewable material resources from water
159,974	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
159,975	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
219,806	unit_normalization	unit_iri	—	https://vocab.brightway.one/units/unit/KiloGM	Unit IRI set from normalization of 'kg'
220,917	unit_normalization	unit_iri	—	https://vocab.brightway.one/units/unit/M3	Unit IRI set from normalization of 'm3'
225,618	normalize_name_case	prefLabel	[{"@value":"Water (rain water)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed…	[{"@value":"Water (rain Water)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed…	Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character)
227,054	ec_cross_check	ec_numbers	[]	["231-791-2"]	Resolved from EC-inventory: 231-791-2 from CAS 7732-18-5
245,632	enrich_references	properties	{}	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1, commonchemistry_cas=['7732-18-5'])
245,633	enrich_references	skos_definition	—	[{"@value":"An oxygen hydride consisting of an oxygen atom that is covalently bonded to two hydrogen atoms","@language"…	Merged ChEBI/PubChem definitions into skos:definition
245,634	enrich_references	references	[]	[{"@id":"gmelin:117","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"consen…	Added references with provenance; cas_numbers=['7732-18-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_15377']; candidate_pubchem_cids=[962, 14798, 5460604, 10214376, 22247451]; selected_pubchem_cids=[962]; 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
253,640	rdkit_pre_consensus	properties	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	rdkit_pre_consensus from 'O'; added: monoisotopic_mass
256,969	chebi_altlabels	altLabel	[]	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	Added 19 ChEBI synonym(s) as altLabel from 2 linked ChEBI record(s)
257,484	strip_cross_object_altlabels	altLabel	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	Removed 1 altLabel value(s) that duplicate another flow object's prefLabel: 'WATER'
271,309	consensus_match	altLabel	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	group_key=rainwater\|\|dimension=Resource > media=Water > water_body=Unknown; cas=7732-18-5; added Common Chemistry CAS names as altLabel: Aquafina, Distilled water, Hydrogen oxide (H<sub>2</sub>O), MeSH ID: D014867, Milli-Q water, NSC 147337, R 718, Ultrex II Ultrapure, Water; object_uuid=fo-35c89da53ceae55f
271,310	consensus_match	cas_match_labels	—	{"7732-18-5":"exactMatch"}	group_key=rainwater\|\|dimension=Resource > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'7732-18-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-35c89da53ceae55f: {'7732-18-5': 'exactMatch'}
278,869	opsin_iupac	properties	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'dihydridooxygen'
285,669	rdkit_post_consensus	properties	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	rdkit_post_consensus from 'O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass
291,252	strip_catalogue_altlabels	altLabel	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	Removed 2 catalogue altLabel value(s): 'NSC 147337' (registry code), 'R 718' (grade code)
313,558	carry_associations_onto_flows	concept_associations	[]	[{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2a240c57-b782-…	associations resolved on the elementary layer
361,031	carry_associations_onto_flows	concept_associations	[]	[{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b9a77a95-26bb-…	associations resolved on the elementary layer
393,243	normalise_property_values	properties	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	{"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["H2O"],"att…	typed the way the ontology types it
402,104	link_flows_to_their_substance	types	—	["https://w3id.org/chemrof/NeutralMolecule","http://purl.obolibrary.org/obo/ENVO_01000600"]	the substance's answer, copied onto its flow
403,991	substance_label_v1	altLabel	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	[{"@value":"((1)H2)water","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"co…	demoted by the substance's name: Water (rain Water)
403,992	substance_label_v1	prefLabel	[{"@value":"Water (rain Water)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed…	[{"@value":"Rainwater","@language":"en","@lang":"en","source":{"prov:wasGeneratedBy":"substance_label_v1","prov:wasAttr…	the substance's name: Rainwater