methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate (CAS 7432-44-2) — formula C27H44O6, molecular weight 464.6; category organic chemicals.
| CAS Number | 7432-44-2 |
|---|---|
| Molecular Formula | C27H44O6 |
| Molecular Weight | 464.6 |
| LogP | 4.5 |
| Category | Organic Chemicals |
methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate is a carbon-based organic compound with CAS registry number 7432-44-2 and molecular formula C27H44O6 (molecular weight 464.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7432-44-2
Its molecular formula C27H44O6 comprises 27 C, 44 H, 6 O atoms.
Also known as: methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate · (3α,5β,7α,12α)-7-乙酰氧基-3,12-二羟基胆烷-24-燕麦酸甲酯
Category: organic chemicals
The CAS registry number of methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate is 7432-44-2.
Molecular formula C27H44O6, molecular weight 464.6.
It is also registered under: methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate, (3α,5β,7α,12α)-7-乙酰氧基-3,12-二羟基胆烷-24-燕麦酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate (CAS 7432-44-2), compiled from public chemistry databases.
| CAS 号 | 7432-44-2 |
|---|---|
| PubChem CID | 99286 |
| 分子式 | C27H44O6 |
| IUPAC 名称 | methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-7-acetyloxy-3,12-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]pentanoate |
| UNII（FDA） | NS00047337 |
| Molecular Weight | 464.6 |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 464.31378912 |
| Monoisotopic Mass | 464.31378912 |
| Topological Polar Surface Area | 93.1 |
| Heavy Atom Count | 33 |
7432-44-2; EINECS 231-078-6; Methyl (3alpha,5beta,7alpha,12alpha)-7-acetoxy-3,12-dihydroxycholan-24-oate; CHEMBL3391982; SCHEMBL15628768; NSC 204979; NS00047337
(3α,5β,7α,12α)-7-乙酰氧基-3,12-二羟基胆烷-24-燕麦酸甲酯 · CAS 7432-44-2 · C27H44O6. UNII NS00047337.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.