Ontology mapping
- Primary identifier
-
CHEBI:4021
Chemical properties
- Cas rn
- 4449-51-8
- Data source
- CultureBotHT compounds_to_cas.csv
- Retrieval date
- 2026-04-29T06:04:17.380972+00:00
- Molecular formula
- C27H41NO2
- Inchi
- InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1
- Smiles
- [H][C@]12CC3=C(C)[C@]4(CC[C@@]3([H])[C@]1([H])CC=C1C[C@@H](O)CC[C@@]12C)O[C@]1([H])C[C@H](C)CN[C@@]1([H])[C@H]4C
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=4449-51-8); Imported from CultureBotHT. |
| 2026-05-01T07:35:33.015554+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (CHEBI primary) | |
| 2026-05-01T08:08:28.925349+00:00 | auto_classify_ingredient_type | AUTO_BACKFILL_CHEBI_CHEMISTRY | molecular_formula=C27H41NO2; inchi=InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27; smiles=[H][C@]12CC3=C(C)[C@]4(CC[C@@]3([H])[C@]1([H])CC=C | |
| 2026-05-02T03:12:13.674854+00:00 | auto_classify_ingredient_type | AUTO_CLASSIFY_INGREDIENT_TYPE | set ingredient_type=SINGLE_INGREDIENT (chemical structure populated (molecular_formula)) |