(3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid (CAS 2097-89-4) — formula C27H40O8, molecular weight 492.6; category organic chemicals.
(3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid is a carbon-based organic compound with CAS registry number 2097-89-4 and molecular formula C27H40O8 (molecular weight 492.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2097-89-4
Its molecular formula C27H40O8 comprises 27 C, 40 H, 8 O atoms.
Also known as: (3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid · Cholan-24-oic acid,3,7,12-tris[(trimethylsilyl)oxy]-, (2-nitrophenyl)methyl ester, (3a,5b,7a,12a)- (9CI)
Category: organic chemicals
The CAS registry number of (3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid is 2097-89-4.
Molecular formula C27H40O8, molecular weight 492.6.
It is also registered under: (3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid, Cholan-24-oic acid,3,7,12-tris[(trimethylsilyl)oxy]-, (2-nitrophenyl)methyl ester, (3a,5b,7a,12a)- (9CI).
Category: Organic Chemicals.
Public-database records for (3alpha,5beta,7alpha,12alpha)-3,7,12-Tris(formyloxy)cholan-24-oic acid (CAS 2097-89-4), reproduced here for independent cross-checking.
| CAS 号 | 2097-89-4 |
|---|---|
| PubChem CID | 10767449 |
| 分子式 | C27H40O8 |
| IUPAC 名称 | (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-triformyloxy-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 |
2097-89-4; Cholan-24-oic acid, 3,7,12-tris(formyloxy)-, (3alpha,5beta,7alpha,12alpha)-; SCHEMBL7879980; DB-246973; 3a,7a,12a-triformyloxy-5b-cholan-24-oic acid; (3Alpha,5beta,7alpha,12alpha)-3,7,12-tris(formyloxy)cholan-24-oic acid
| 分子量 | 492.6 |
|---|---|
| XLogP3 | 5.3 |
| 氢键供体数 | 1 |
| 氢键受体数 | 8 |
| 可旋转键数 | 10 |
| 精确质量 | 492.27231823 |
| 单同位素质量 | 492.27231823 |
| 拓扑极性表面积 | 116 |
| 重原子数 | 35 |
| 形式电荷 | 0 |
3α,7α,12α-三甲酰氧基-5β-胆-24-酸 · CAS 2097-89-4 · C27H40O8.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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