Ontology mapping
- Primary identifier
-
CHEBI:16619 - Ontology label
- (2-trans,6-trans)-farnesol
Rejected enrichment labels (1)
Provenance-only candidates: these are not synonyms and do not resolve to this record.
| Rejected label | Disposition | Source | Occurrences |
|---|---|---|---|
| 3,7,11-trimethyldodeca-2,6,10-trien-1-ol | REJECTED_LABEL | chebi_synonym_review |
Chemical properties
- Data source
- PubChem CID 445070
- Retrieval date
- 2026-09-12T00:00:00+00:00
- Molecular formula
- C15H26O
- Cas rn
- 106-28-5
- Pubchem cid
- 445070
- Inchi
- InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+
- Smiles
- CC(C)=CCC/C(C)=C/CC/C(C)=C/CO
Evidence (2)
DATABASE_MATCH
via CultureBotHT
SUPERSEDED (#456): the CAS-selected ChEBI term denotes a broader stereochemical parent. Original note follows. Imported from CultureBotHT. CAS-RN→CHEBI mapping resolved via OAK CHEBI sqlite (cas xref).
CURATOR_JUDGMENT
via MIM curation (#456)
The CultureBotHT label names the (2E,6E) isomer. CHEBI:16619 and PubChem CID 445070 denote (2-trans,6-trans)-farnesol, while the old CHEBI:28600 target and CAS 4602-84-0 are stereo-unspecified. The record now maps exactly to CHEBI:16619 instead of the old CHEBI:28600 stereo-unspecified parent.
Occurrence statistics
- Total occurrences
- 0
- Distinct media
- 0
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-04-29T06:34:31.158938+00:00 | audit_cas_chebi_followup | CREATED_FROM_CAS_LOOKUP | MAPPED | Created from CultureBotHT CAS-RN=4602-84-0; CHEBI resolved via OAK CHEBI sqlite (cas xref); Imported from CultureBotHT. CAS-RN→CHEBI mapping resolved via OAK CHEBI sqlite (cas xref). |
| 2026-05-01T07:35:36.679697+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:32.761593+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C15H26O; inchi=InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11; smiles=[H]C(CO)=C(C)CCC([H])=C(C)CCC=C(C)C | |
| 2026-05-02T03:12:18.943181+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) | |
| 2026-09-12T00:00:00+00:00 | fix_cas_stereochemical_identity_conflicts | REGROUNDED_STEREOCHEMICAL_FORM | MAPPED | identifier CHEBI:28600 -> CHEBI:16619; ontology mapping set to EXACT_MATCH CHEBI:16619 ('(2-trans,6-trans)-farnesol'). Replaced target-derived chemistry and marked 1 inherited ChEBI synonym(s) as REJECTED_LABEL (#456). |