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Name | 7beta, 25-dihydroxycholesterol |
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Molecular formula | C27H46O3 |
IUPAC name | (3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol |
Molecular weight | 418.662 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 5.7 |
Synonyms | GTPL4355 7beta,25-dihydroxycholesterol CHEMBL3311219 (3S,7R,8S,9S,10R,13R,14S,17R)-17-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol SCHEMBL2485860 [ Show all ] |
Inchi Key | BQMSKLCEWBSPPY-CGSQRZAOSA-N |
Inchi ID | InChI=1S/C27H46O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h16-17,19-24,28-30H,6-15H2,1-5H3/t17-,19+,20-,21+,22+,23+,24+,26+,27-/m1/s1 |
PubChem CID | 473142 |
ChEMBL | N/A |
IUPHAR | 4355 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
553408 | G-protein coupled receptor 183 | P32249 | GPR183 | Homo sapiens (Human) | 361 |
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