(3β,25R)-Hydroxy-5-cholestenoic acid
| Catalog Number | BL-M001324 |
| CAS Number | 56845-87-5 |
| Description | (3β,25R)-Hydroxy-5-cholestenoic acid is a metabolite of 27-hydroxycholesterol. |
 | |
| IUPAC Name | (2R,6R)-6-[(3S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid |
| Synonyms | Cholest-5-en-26-oic acid, 3-hydroxy-, (3β,25R)-; (3β,25R)-3-Hydroxycholest-5-en-26-oic acid; (2R,6R)-6-((3S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptanoic acid; (25R)-3beta-hydroxycholest-5-en-26-oic acid |
| Molecular Weight | 416.64 |
| Molecular Formula | C27H44O3 |
| Boiling Point | 551.4±23.0°C at 760 mmHg |
| Melting Point | 175-177°C |
| Purity | >99% |
| Density | 1.08±0.1 g/cm3 |
| Solubility | Soluble in Methanol |
| Appearance | Powder |
| Shelf Life | 1 Year |
| Storage | Store at -20°C |
| Percent Composition | C 77.83%, H 10.64%, O 11.52% |
| Canonical SMILES | CC(CCCC(C)C(=O)O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C |
| InChI | InChI=1S/C27H44O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h8,17-18,20-24,28H,5-7,9-16H2,1-4H3,(H,29,30)/t17-,18-,20+,21+,22-,23+,24+,26+,27-/m1/s1 |
| InChI Key | WVXOMPRLWLXFAP-KQOPCUSDSA-N |
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