(3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid (CAS 80875-93-0) — formula C24H40O6, molecular weight 424.6; category organic chemicals.
| CAS Number | 80875-93-0 |
|---|---|
| Molecular Formula | C24H40O6 |
| Molecular Weight | 424.6 |
| Melting Point | 165 - 167 °C |
| LogP | 2.6 |
| Category | Organic Chemicals |
(3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid is a carbon-based organic compound with CAS registry number 80875-93-0 and molecular formula C24H40O6 (molecular weight 424.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80875-93-0
Its molecular formula C24H40O6 comprises 24 C, 40 H, 6 O atoms.
Also known as: (3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid · 化合物 3α,6β,7α,12α-Tetrahydroxy bile acid
Category: organic chemicals
The CAS registry number of (3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid is 80875-93-0.
Molecular formula C24H40O6, molecular weight 424.6.
It is also registered under: (3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid, 化合物 3α,6β,7α,12α-Tetrahydroxy bile acid.
Category: Organic Chemicals.
Independent reference data for (3a,5b,6b,7a,12a)-3,6,7,12-tetrahydroxy-Cholan-24-oic acid (CAS 80875-93-0), compiled from public chemistry databases.
| CAS 号 | 80875-93-0 |
|---|---|
| PubChem CID | 5283899 |
| 分子式 | C24H40O6 |
| IUPAC 名称 | (4R)-4-[(3R,5R,6S,7S,8R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-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 |
| Molecular Weight | 424.6 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 424.28248899 |
| Monoisotopic Mass | 424.28248899 |
| Topological Polar Surface Area | 118 |
| Heavy Atom Count | 30 |
| Melting Point | 165 - 167 °C |
|---|
3alpha,6beta,7alpha,12alpha-Tetrahydroxy-5beta-cholan-24-oic Acid; 80875-93-0; 3alpha,6beta,7alpha,12alpha-Tetrahydroxy-5beta-cholanoic acid; 3a,6b,7a,12a-Tetrahydroxy-5b-cholanoic acid; orb3145051; SCHEMBL1492077; CHEBI:166709; DTXSID201261162; LMST04010120; TYD-04396; 3a,6b,7a,12a-Tetrahydroxy-5b-cholanoate; 3a,6b,7a,12a-Tetrahydroxy-5b-cholan-24-oic acid; Q63392374; 3I+/-,6I(2),7I+/-,12I+/--Tetrahydroxy-5I(2)-cholanoic acid
化合物 3α,6β,7α,12α-Tetrahydroxy bile acid · CAS 80875-93-0 · C24H40O6. Melting Point: 165 - 167 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.