Basic Information
| Drug ID | DDPD00153 |
|
| Drug Name | Ergocalciferol | |
| Molecular Weight | 396.6484 | |
| Molecular Formula | C28H44O | |
| CAS Number | 50-14-6 | |
| SMILES | CC(C)[C@@H](C)\C=C\[C@@H](C)[C@@]1([H])CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)CCC1=C | |
| External Links | ||
| DRUGBANK | DB00153 | |
| T3DB | T3D2697 | |
| PubChem Compound | 5280793 | |
| PDR | 1904 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 8.89 | - | 8.89 | - | 'MSDS' |
| Melting Point | 116.0 | ℃ | 115-117 | ℃ | Saxena P. 2007. Chemistry of alkaloids |
| pKa | 6.35 | - | 6.35 | - | Hart J. and Norman M. 1992. The Analyst. |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Half-life | 36.0 | h | 1-2 | day | DRUGBANK | |
| Toxicity LD50 | 10.0 | mg/kg | 10.0 | mg/kg | PO, oral; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 23.7 | mg/kg | 23.7 | mg/kg | PO, oral; mouse; | T3DB | Toxicity LD50 | 10.0 | mg/kg | 10.0 | mg/kg | PO, oral; Rattus, Rat; | T3DB |
Maximum Dosage
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Brand Name | Component | Reference |
|---|---|---|---|---|---|---|---|---|
| Max dose for neonates | 0.0375 | mg/day | 37.5 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for neonates | 1500.0 | International Units/day | 1500 | International Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for neonates | 0.025 | mg/day | 25 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for neonates | 1000.0 | International Units/day | 1000 | International Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 0.1 | mg/day | 100 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 4000.0 | InternationaL Units/day | 4000 | InternationaL Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 0.075 | mg/day | 75 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 3000.0 | InternationaL Units/day | 3000 | InternationaL Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 0.0625 | mg/day | 62.5 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for infants | 2500.0 | InternationaL Units/day | 2500 | InternationaL Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for children | 0.1 | mg/day | 100 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for children | 4000.0 | International Units/day | 4000 | International Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for adolescents | 0.1 | mg/day | 100 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for adolescents | 4000.0 | units/day | 4000 | International Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for geriatric | 0.1 | mg/day | 100 | mcg/day | PO, oral | Drisdol | ergocalciferol | PDR |
| Max dose for geriatric | 4000.0 | International Units/day | 4000 | International Units/day | PO, oral | Drisdol | ergocalciferol | PDR |
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1