(S)-Ibuprofen-acyl-beta-D-glucuronide (CAS 98649-76-4) — formula C19H26O8, molecular weight 382.4; category organic chemicals.
| CAS Number | 98649-76-4 |
|---|---|
| Molecular Formula | C19H26O8 |
| Molecular Weight | 382.4 |
| LogP | 2 |
| Category | Organic Chemicals |
(S)-Ibuprofen-acyl-beta-D-glucuronide is a carbon-based organic compound with CAS registry number 98649-76-4 and molecular formula C19H26O8 (molecular weight 382.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 98649-76-4
Its molecular formula C19H26O8 comprises 19 C, 26 H, 8 O atoms.
Also known as: (S)-Ibuprofen-acyl-beta-D-glucuronide · （S）-布洛芬葡糖苷酸
Category: organic chemicals
The CAS registry number of (S)-Ibuprofen-acyl-beta-D-glucuronide is 98649-76-4.
Molecular formula C19H26O8, molecular weight 382.4.
It is also registered under: (S)-Ibuprofen-acyl-beta-D-glucuronide, （S）-布洛芬葡糖苷酸.
Category: Organic Chemicals.
Independent reference data for (S)-Ibuprofen-acyl-beta-D-glucuronide (CAS 98649-76-4), compiled from public chemistry databases.
| CAS 号 | 98649-76-4 |
|---|---|
| PubChem CID | 92278491 |
| 分子式 | C19H26O8 |
| IUPAC 名称 | (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]oxyoxane-2-carboxylic acid |
| UNII（FDA） | BFC9XP4HR9 |
| Molecular Weight | 382.4 |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 382.16276778 |
| Monoisotopic Mass | 382.16276778 |
| Topological Polar Surface Area | 134 |
| Heavy Atom Count | 27 |
98649-76-4; beta-D-Glucopyranuronic acid, 1-[(alphaS)-alpha-methyl-4-(2-methylpropyl)benzeneacetate]; beta-D-Glucopyranuronic acid, 1-((alphaS)-alpha-methyl-4-(2-methylpropyl)benzeneacetate); RefChem:329026; (S)-Ibuprofen glucuronide; Ibuprofen Acyl-beta-D-glucuronide; (S)-Ibuprofen-acyl-b-D-glucuronide; S-Ibuprofen-Acyl-beta-D-Glucuronide; BFC9XP4HR9; orb2567303; CHEMBL3526450; Dexibuprofen-acyl-b-D-glucuronide; DTXSID301139429; MFCD00870750; (S)-Ibuprofen acyl-|A-D-glucuronide; HY-113018A
（S）-布洛芬葡糖苷酸 · CAS 98649-76-4 · C19H26O8. UNII BFC9XP4HR9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: （S）-布洛芬葡糖苷酸