(3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid (CAS 94159-47-4) — formula C28H44O8, molecular weight 508.6; category organic chemicals.
| CAS Number | 94159-47-4 |
|---|---|
| Molecular Formula | C28H44O8 |
| Molecular Weight | 508.6 |
| LogP | 3.6 |
| Category | Organic Chemicals |
(3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid is a carbon-based organic compound with CAS registry number 94159-47-4 and molecular formula C28H44O8 (molecular weight 508.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94159-47-4
Its molecular formula C28H44O8 comprises 28 C, 44 H, 8 O atoms.
Also known as: (3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid · 化合物 3-sucCA
Category: organic chemicals
The CAS registry number of (3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid is 94159-47-4.
Molecular formula C28H44O8, molecular weight 508.6.
It is also registered under: (3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid, 化合物 3-sucCA.
Category: Organic Chemicals.
Independent reference data for (3alpha,5beta,7alpha,12beta)-3-(3-carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid (CAS 94159-47-4), compiled from public chemistry databases.
| CAS 号 | 94159-47-4 |
|---|---|
| PubChem CID | 44150293 |
| 分子式 | C28H44O8 |
| IUPAC 名称 | (4R)-4-[(3R,5R,7R,8R,9S,10S,12R,13R,14S,17R)-3-(3-carboxypropanoyloxy)-7,12-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]pentanoic acid |
| UNII（FDA） | NS00040193 |
| Molecular Weight | 508.6 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 9 |
| Exact Mass | 508.30361836 |
| Monoisotopic Mass | 508.30361836 |
| Topological Polar Surface Area | 141 |
| Heavy Atom Count | 36 |
EINECS 303-227-6; (3alpha,5beta,7alpha,12beta)-3-(3-Carboxy-1-oxopropoxy)-7,12-dihydroxycholan-24-oic acid; NS00040193
化合物 3-sucCA · CAS 94159-47-4 · C28H44O8. UNII NS00040193.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 化合物 3-sucCA