Tauroursodeoxycholic acid (CAS 14605-22-2) — formula C26H45NO6S, molecular weight 499.7; category organic chemicals.
| CAS Number | 14605-22-2 |
|---|---|
| Molecular Formula | C26H45NO6S |
| Molecular Weight | 499.7 |
| LogP | 3.6 |
| Category | Organic Chemicals |
Tauroursodeoxycholic acid is a carbon-based organic compound with CAS registry number 14605-22-2 and molecular formula C26H45NO6S (molecular weight 499.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 14605-22-2
Its molecular formula C26H45NO6S comprises 26 C, 45 H, 1 N, 6 O, 1 S atoms.
Also known as: Tauroursodeoxycholic acid · 牛磺熊去氧胆酸
Category: organic chemicals
The CAS registry number of Tauroursodeoxycholic acid is 14605-22-2.
Molecular formula C26H45NO6S, molecular weight 499.7.
It is also registered under: Tauroursodeoxycholic acid, 牛磺熊去氧胆酸.
Category: Organic Chemicals.
Independent reference data for Tauroursodeoxycholic acid (CAS 14605-22-2), compiled from public chemistry databases.
| CAS Registry Number | 14605-22-2 |
|---|---|
| PubChem CID | 9848818 |
| Molecular formula | C26H45NO6S |
| IUPAC name | 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid |
| UNII (FDA) | 60EUX8MN5X |
| Molecular Weight | 499.7 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 499.29675933 |
| Monoisotopic Mass | 499.29675933 |
| Topological Polar Surface Area | 132 |
| Heavy Atom Count | 34 |
Tauroursodeoxycholic acid; 14605-22-2; TUDCA; Ursodeoxycholyltaurine; Taurursodiol; ursodoxicoltaurine; Taurolite; UR 906; Tauroursodesoxycholic acid; Ur-906; 60EUX8MN5X; N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)-taurine; CHEBI:80774; N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)taurine; 3alpha,7beta-dihydroxy-5beta-cholanoyltaurine; RefChem:187542
| Reported hazard statements | H314 (100%), H318 (100%) |
|---|
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Tauroursodeoxycholic acid · CAS 14605-22-2 · C26H45NO6S. UNII 60EUX8MN5X.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 牛磺熊去氧胆酸