crocin
(SEBIKDIMAPSUBY-RTJKDTQDSA-N)
Structure
- SMILES
- OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](OC(=O)/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@H]([C@@H]([C@H]4O)O)O)[C@H]([C@@H]([C@H]3O)O)O)\C)\C)/C)/C)[C@@H]([C@H]([C@@H]2O)O)O)[C@@H]([C@H]([C@@H]1O)O)O
- Type(s)
- Investigational
- Molecular Formula:
- C44H64O24
- Molecular Weight:
- 976.965
- Log P:
- -5.2252
- Hydrogen Bond Acceptor:
- 24
- Hydrogen Bond Donor:
- 14
- TPSA:
- 391.2
- CAS Number(s):
- 11012-59-2; 39465-00-4; 42553-65-1; 94238-00-3
Synonym(s)
1.
crocin
2.
alpha-crocin
External Link(s)
| MeSH | C029036 |
| PubChem Compound | 5281233 |
| BindingDB | 50260195 |
| ChEBI | 79068 |
| CHEMBL | CHEMBL446785 |
| DrugBank | DB11874 |
| KEGG | cpd:C08589 |
| ZINC | 245224178 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Atherosclerosis | 15964309 | CTD | |
| 2 | Cardiomegaly | 23523949 | CTD | |
| 3 | Cardiotoxicity | 26095701 26807765 | CTD | |
| 4 | Cognition Disorders | 20683499 | CTD | |
| 5 | Depressive disorder | 24401376 | CTD | |
| 6 | Hyperglycemia | 29409856 | CTD | |
| 7 | Hypotension | 24392635 | CTD | |
| 8 | Inflammation | 23523949 | CTD | |
| 9 | Kidney Diseases | 25899501 26584762 | CTD | |
| 10 | Liver diseases | 26584762 | CTD | |
| 11 | Necrosis | 23523949 | CTD | |
| 12 | Parkinsonian Disorders | 26705857 | CTD | |
| 13 | Ulcer | 25637687 | CTD |
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