Ontology mapping
- Primary identifier
-
CHEBI:44718
Chemical properties
- Cas rn
- 104504-45-2
- Data source
- CultureBotHT compounds_to_cas.csv
- Retrieval date
- 2026-04-29T06:04:17.380972+00:00
- Molecular formula
- C16H15NO3
- Inchi
- InChI=1S/C16H15NO3/c17-14(16(19)20)10-11-6-8-13(9-7-11)15(18)12-4-2-1-3-5-12/h1-9,14H,10,17H2,(H,19,20)/t14-/m0/s1
- Smiles
- N[C@@H](Cc1ccc(C(=O)c2ccccc2)cc1)C(=O)O
Evidence (1)
DATABASE_MATCH
via CultureBotHT
Imported from CultureBotHT.
Occurrence statistics
- Total occurrences
- 0
- Distinct media
- 0
Curation history
| Timestamp | Curator | Action | New status | Changes |
|---|---|---|---|---|
| 2026-04-29T06:04:17.380972+00:00 | audit_integrate_culturebotht | CREATED_FROM_CULTUREBOTHT | MAPPED | Created from CultureBotHT compounds_to_cas.csv (CAS=104504-45-2); Imported from CultureBotHT. |
| 2026-05-01T07:35:31.916179+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:27.739176+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C16H15NO3; inchi=InChI=1S/C16H15NO3/c17-14(16(19)20)10-11-6-8-13(9-; smiles=N[C@@H](Cc1ccc(C(=O)c2ccccc2)cc1)C(=O)O | |
| 2026-05-02T03:12:12.109715+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) |