6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one
Everything that changed this flow. Back to the flow
65690cd9-f01c-4701-aac3-17d338835b58
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 | 2 | consensus_match, strip_catalogue_altlabels | Removed 6 catalogue altLabel value(s): 'BK 400' (grade code), 'Black 400' (trade name), 'CK 68' (grade code), 'H 272' (grade code), 'H 638' (grade code), 'ODB 2' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one||dimension=Environmental > media=Air > strata=Long-term; group_sources=['pubchem']; cas_sources={'89331-94-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0800061aaad3951d: {'89331-94-2': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['89331-94-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[3534526, 45356846]; selected_pubchem_cids=[3534526]; 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 |
|---|---|---|---|---|---|
| 2,246 | bootstrap_labels | prefLabel | — | [{"@value":"6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one","@language":"e… | Bootstrapped prefLabel from legacy name field |
| 2,247 | bootstrap_labels | name | 6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one | — | Purged legacy name field to enforce prefLabel usage |
| 2,248 | bootstrap_labels | synonyms | ["organic","6'","-(dibutylamino)-3'","-methyl-2'","-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-… | [] | Removed legacy synonyms field in favor of structured labels |
| 110,160 | 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 |
| 110,161 | 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 |
| 214,087 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,340 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,341 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,342 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J60.931E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['89331-94-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[3534526, 45356846]; selected_pubchem_cids=[3534526]; 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 |
| 248,942 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | rdkit_pre_consensus from 'CCCCN(CCCC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C(C(=C5)NC6=CC=CC=C6)C'; added: molecular_mass, monoisotopic_mass |
| 263,170 | consensus_match | altLabel | [] | [{"@value":"2-Anilino-3-methyl-6-(di-<em>n</em>-butylamino)fluoran","@language":"en","source":{"prov:wasGeneratedBy":"c… | group_key=6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one||dimension=Environmental > media=Air > strata=Long-term; cas=89331-94-2; added Common Chemistry CAS names as altLabel: 2-Anilino-3-methyl-6-(di-<em>n</em>-butylamino)fluoran, 2-Anilino-3-methyl-6-(dibutylamino)fluoran, 2-Anilino-6-di-<em>n</em>-butylamino-3-methylfluoran, 2-Anilino-6-dibutylamino-3-methylfluoran, 2-Phenylamino-3-methyl-6-(di-<em>n</em>-butylamino)fluorane, 2′-Anilino-3′-methyl-6′-(dibutylamino)fluoran, 2′-Anilino-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one, 3-(<em>N</em>,<em>N</em>-Dibutylamino)-6-methyl-7-anilinofluoran, 3-Di-<em>n</em>-butylamino-6-methyl-7-anilinofluoran, 3-Dibutylamino-6-methyl-7-anilinofluoran, 3-Dibutylamino-6-methyl-7-phenylaminofluoran, 3′-(Dibutylamino)-6′-methyl-7′-anilinofluoran, 6′-(Dibutylamino)-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3<em>H</em>),9′-[9<em>H</em>]xanthen]-3-one, 7-Anilino-3-(dibutylamino)-6-methylfluoran, 7′-Anilino-3′-(dibutylamino)-6′-methylfluoran, BK 400, Black 400, CK 68, Chameleon Black 2, Copikem 34, Copikem 34 Black, H 272, H 638, ODB 2, Pergascript Black 2C, Spiro[isobenzofuran-1(3<em>H</em>),9′-[9<em>H</em>]xanthen]-3-one, 6′-(dibutylamino)-3′-methyl-2′-(phenylamino)-, Wincon 2; object_uuid=fo-0800061aaad3951d |
| 263,171 | consensus_match | cas_match_labels | — | {"89331-94-2":"exactMatch"} | group_key=6'-(dibutylamino)-3'-methyl-2'-(phenylamino)spiro[isobenzofuran-1(3h),9-(9h)-xanthen]-3-one||dimension=Environmental > media=Air > strata=Long-term; group_sources=['pubchem']; cas_sources={'89331-94-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0800061aaad3951d: {'89331-94-2': 'exactMatch'} |
| 274,060 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2′-Anilino-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one' |
| 280,470 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | rdkit_post_consensus from 'CCCCN(CCCC)c1ccc2c(c1)Oc1cc(C)c(Nc3ccccc3)cc1C21OC(=O)c2ccccc21'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,695 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Anilino-3-methyl-6-(di-<em>n</em>-butylamino)fluoran","@language":"en","source":{"prov:wasGeneratedBy":"c… | [{"@value":"2-Anilino-3-methyl-6-(di-n-butylamino)fluoran","@language":"en","source":{"prov:wasGeneratedBy":"consensus_… | Removed 6 catalogue altLabel value(s): 'BK 400' (grade code), 'Black 400' (trade name), 'CK 68' (grade code), 'H 272' (grade code), 'H 638' (grade code), 'ODB 2' (grade code) |
| 336,079 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/65690cd9-f01c-… | associations resolved on the elementary layer |
| 388,351 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C35H36N2O3… | typed the way the ontology types it |
| 395,046 | 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/20260821T1554374006150000/2246 | prefLabel | ef:agent/bootstrap_labels | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v0 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v1 |
| ef:activity/change/20260821T1554374006150000/2247 | name | ef:agent/bootstrap_labels | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v1 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v2 |
| ef:activity/change/20260821T1554374006150000/2248 | synonyms | ef:agent/bootstrap_labels | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v2 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v3 |
| ef:activity/change/20260821T1554374006150000/110160 | context | ef:agent/default_context_mapping | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v3 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v4 |
| ef:activity/change/20260821T1554374006150000/110161 | context_iri | ef:agent/default_context_mapping | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v4 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v5 |
| ef:activity/change/20260821T1554374006150000/214087 | unit_iri | ef:agent/unit_normalization | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v5 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v6 |
| ef:activity/change/20260821T1554374006150000/229340 | properties | ef:agent/enrich_references | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v6 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v7 |
| ef:activity/change/20260821T1554374006150000/229341 | skos_definition | ef:agent/enrich_references | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v7 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v8 |
| ef:activity/change/20260821T1554374006150000/229342 | references | ef:agent/enrich_references | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v8 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v9 |
| ef:activity/change/20260821T1554374006150000/248942 | properties | ef:agent/rdkit_pre_consensus | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v9 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v10 |
| ef:activity/change/20260821T1554374006150000/263170 | altLabel | ef:agent/consensus_match | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v10 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v11 |
| ef:activity/change/20260821T1554374006150000/263171 | cas_match_labels | ef:agent/consensus_match | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v11 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v12 |
| ef:activity/change/20260821T1554374006150000/274060 | properties | ef:agent/opsin_iupac | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v12 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v13 |
| ef:activity/change/20260821T1554374006150000/280470 | properties | ef:agent/rdkit_post_consensus | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v13 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v14 |
| ef:activity/change/20260821T1554374006150000/287695 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v14 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v15 |
| ef:activity/change/20260821T1554374006150000/336079 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v15 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v16 |
| ef:activity/change/20260821T1554374006150000/388351 | properties | ef:agent/normalise_property_values | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v16 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v17 |
| ef:activity/change/20260821T1554374006150000/395046 | types | ef:agent/link_flows_to_their_substance | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v17 | ef:flow/65690cd9-f01c-4701-aac3-17d338835b58/v18 |