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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	Hombreol
Molecular formula	C19H32O2
IUPAC name	(3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Molecular weight	292.463
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	4.2
Synonyms	Androstane-3,17-diol, (3alpha,5alpha,17beta)- C-18356 DTXSID3022378 KB-196525 Opera_ID_1641 17beta-dihydroandrosterone 3alpha,17beta-Dihydroxy-5alpha-androstane 5.alpha.-Androstane-3.alpha.,17.beta.-diol 852A535 Androstane-3a,17b-diol CHEBI:36713 Etiocholane-3alpha,17beta-diol MFCD00003676 SMR000058611 3-alpha,17-beta-Dihydroxy-5-alpha-androstane 3\|A,17\|A- paragraph signthornoC>>u-5\|A-EthUcThornIe 5alpha-Androstan-3alpha,17beta-diol AC1Q59M5 ANDROSTANDIOL BRN 2694353 DB01530 J34MX0M30Y NIOSH/BV8044300 ZINC3814411 (3alpha,5alpha,17beta)-androstane-3,17-diol 3a-androstanediol 5-alpha-androstan-3alpha,17beta-diol 5alpha-Androstane-3alpha,17beta-diol Androstane-3,17-diol, (3alpha,5alpha,17beta)- (9CI) C03852 EINECS 217-447-4 LMST02020052 paragraph signthornCaEthUcThornI feminine 1852-53-5 3alpha-androstanediol AC-12630 BDBM50093445 HMS2236G09 MLS000028362 UNII-J34MX0M30Y 3a,17b-Dihydroxy-5a-androstane 4-06-00-06097 (Beilstein Handbook Reference) 5Alpha-androstane-3alpha pound not17beta-diol AKOS015960923 Androstane-3,17-diol, (3-alpha,5-alpha,17-beta)- BV80443000 Dihydroandrosterone Jsp003797 NSC 9899 (3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol 3alpha androstanediol 5-alpha-ANDROSTANE-3-alpha,17-beta-DIOL 5alpha-Androstane-3alpha,17beta-diol (8CI) Androstane-3-alpha,17-beta-diol CBMYJHIOYJEBSB-KHOSGYARSA-N Etiocholane-3a,17b-diol LS-19354 SCHEMBL869146 3-alpha,17-beta-Androstanediol 3\|A androstanediol 5a-Androstane-3a,17b-diol AC1L26OX Androstan-3alpha,17beta-diol BIDD:ER0064 CHEMBL335062 MLS000563089 W-107784 (3.alpha.,5.alpha.,17.beta.)-Androstane-3,17-diol 3a,5a-Tetrahydrotestosterone 5 alfa-Androstane-3beta, 17beta-diol 5alpha-Androstane-3alpha,17beta-androstanediol [ Show all ]
Inchi Key	CBMYJHIOYJEBSB-KHOSGYARSA-N
Inchi ID	InChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17-,18-,19-/m0/s1
PubChem CID	15818
ChEMBL	CHEMBL335062
IUPHAR	N/A
BindingDB	50093445
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
38011	G-protein coupled bile acid receptor 1	Q8TDU6	GPBAR1	Homo sapiens (Human)	330

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