(7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid (CAS 72741-86-7) — formula C26H42N3NaO6S, molecular weight 547.7; category organic chemicals.
| CAS Number | 72741-86-7 |
|---|---|
| Molecular Formula | C26H42N3NaO6S |
| Molecular Weight | 547.7 |
| Category | Organic Chemicals |
(7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid is a carbon-based organic compound with CAS registry number 72741-86-7 and molecular formula C26H42N3NaO6S (molecular weight 547.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72741-86-7
Its molecular formula C26H42N3NaO6S comprises 26 C, 42 H, 3 N, 1 Na, 6 O, 1 S atoms.
Also known as: (7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid · 7,7-偶氮-3-α，12-α-二羟基牛磺胆酸钠盐
Category: organic chemicals
The CAS registry number of (7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid is 72741-86-7.
Molecular formula C26H42N3NaO6S, molecular weight 547.7.
It is also registered under: (7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid, 7,7-偶氮-3-α，12-α-二羟基牛磺胆酸钠盐.
Category: Organic Chemicals.
Independent reference data for (7,7-azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid (CAS 72741-86-7), compiled from public chemistry databases.
| CAS 号 | 72741-86-7 |
|---|---|
| PubChem CID | 23669325 |
| 分子式 | C26H42N3NaO6S |
| IUPAC 名称 | sodium 2-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethylspiro[1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-7,3'-diazirine]-17-yl]pentanoyl]amino]ethanesulfonate |
| Molecular Weight | 547.7 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 547.26920152 |
| Monoisotopic Mass | 547.26920152 |
| Topological Polar Surface Area | 160 |
| Heavy Atom Count | 37 |
7-Adtc; 7,7-Azo-TC; (7,7-Azo-3,12-dihydroxy-5-cholan-24-oyl)-2-aminoethanesulfonic acid; RefChem:69733; 2-(7,7-azo-3,12-dihydroxy-5-cholan-24-oylamino)ethanesulfonic acid; 72741-86-7
7,7-偶氮-3-α，12-α-二羟基牛磺胆酸钠盐 · CAS 72741-86-7 · C26H42N3NaO6S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.