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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	CHEMBL3120631
Molecular formula	C34H49NO6
IUPAC name	(2R,3S,4S,5S,6R)-2-(hydroxymethyl)-6-[[(1S,12S,15R,16S,17S,20S)-1,16,20-trimethyl-16-(4-methylpent-3-enyl)-3-azapentacyclo[10.8.0.02,10.04,9.015,20]icosa-2(10),4,6,8-tetraen-17-yl]oxy]oxane-3,4,5-triol
Molecular weight	567.767
Hydrogen bond acceptor	6
Hydrogen bond donor	5
XlogP	6.0
Synonyms	BDBM50448073 Emindole SB beta-D-mannoside
Inchi Key	RLMHLVYKLURACD-CHRYWTOVSA-N
Inchi ID	InChI=1S/C34H49NO6/c1-19(2)9-8-15-32(3)25-13-12-20-17-22-21-10-6-7-11-23(21)35-30(22)34(20,5)33(25,4)16-14-26(32)41-31-29(39)28(38)27(37)24(18-36)40-31/h6-7,9-11,20,24-29,31,35-39H,8,12-18H2,1-5H3/t20-,24+,25-,26-,27+,28-,29-,31-,32-,33-,34+/m0/s1
PubChem CID	76317959
ChEMBL	CHEMBL3120631
IUPHAR	N/A
BindingDB	50448073
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
299141	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
299139	Cannabinoid receptor 2	P34972	CNR2	Homo sapiens (Human)	360
299138	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319
299140	N-arachidonyl glycine receptor	Q14330	GPR18	Homo sapiens (Human)	331

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