1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid (CAS 96735-71-6) — formula C23H26F3NO7, molecular weight 485.4; category organic chemicals.
| CAS Number | 96735-71-6 |
|---|---|
| Molecular Formula | C23H26F3NO7 |
| Molecular Weight | 485.4 |
| LogP | 0.5 |
| Category | Organic Chemicals |
1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid is a carbon-based organic compound with CAS registry number 96735-71-6 and molecular formula C23H26F3NO7 (molecular weight 485.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96735-71-6
Its molecular formula C23H26F3NO7 comprises 23 C, 26 H, 3 F, 1 N, 7 O atoms.
Also known as: 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid · 1-脱氧-1-[甲基[3-苯基-3-[4-(三氟甲基)苯氧基]丙基]氨基]-BETA-D-吡喃葡萄糖醛酸
Category: organic chemicals
The CAS registry number of 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid is 96735-71-6.
Molecular formula C23H26F3NO7, molecular weight 485.4.
It is also registered under: 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid, 1-脱氧-1-[甲基[3-苯基-3-[4-(三氟甲基)苯氧基]丙基]氨基]-BETA-D-吡喃葡萄糖醛酸.
Category: Organic Chemicals.
Independent reference data for 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid (CAS 96735-71-6), compiled from public chemistry databases.
| CAS 号 | 96735-71-6 |
|---|---|
| PubChem CID | 71316864 |
| 分子式 | C23H26F3NO7 |
| IUPAC 名称 | (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[methyl-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]oxane-2-carboxylic acid |
| Molecular Weight | 485.4 |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 485.16613665 |
| Monoisotopic Mass | 485.16613665 |
| Topological Polar Surface Area | 120 |
| Heavy Atom Count | 34 |
96735-71-6; 1-Deoxy-1-(methyl(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)amino)-beta-D-glucopyranuronic acid; 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-beta-D-glucopyranuronic acid; RefChem:229925; Fluoxetine glucuronide; Fluoxetine N-b-D-Glucuronide; Fluoxetine N-Beta-D-Glucuronide; Fluoxetine N-Glucuronide Sodium Salt; 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-ss-D-glucopyranuronic Acid;; Fluoxetine D-glucuronide (mixture of isomers); CHEBI:173252; DTXSID801116547; 96735-71-6 (free base); MF11750; N-Methyl-N-{3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl}-beta-D-glucopyranuronosylamine; 1-Deoxy-1-[methyl[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-I(2)-D-glucopyranuronic acid
1-脱氧-1-[甲基[3-苯基-3-[4-(三氟甲基)苯氧基]丙基]氨基]-BETA-D-吡喃葡萄糖醛酸 · CAS 96735-71-6 · C23H26F3NO7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.