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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	Frangulin B
Molecular formula	C20H18O9
IUPAC name	3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione
Molecular weight	402.355
Hydrogen bond acceptor	9
Hydrogen bond donor	5
XlogP	1.3
Synonyms	3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione A807715 CHEBI:601858 SCHEMBL1426453 3-[[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)-2-oxolanyl]oxy]-1,8-dihydroxy-6-methylanthracene-9,10-dione BDBM50269014 EINECS 237-953-9 UNII-8CIK094KBU 14101-04-3 8CIK094KBU CC-28849 FT-0626549 3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-1,8-dihydroxy-6-methyl-anthracene-9,10-dione AC1L9DBZ SureCN1426453 C-21749 ZINC4098675 3-(D-Apio-beta-D-furanosyloxy)-1,8-dihydroxy-6-methylanthraquinone 9,10-Anthracenedione,3-(D-apio-b-D-furanosyloxy)-1,8-dihydroxy-6-methyl- CHEBI:5168 I14-44568 3-[(2S,3R,4R)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-methyl-1,8-bis(oxidanyl)anthracene-9,10-dione AKOS015914181 CHEMBL496999 UNII-67L0QX9A48 component AEQMIFRODRFTJF-SLFFLAALSA-N 6-O-(D-Apiofuranosyl)-1,6,8-trihydroxy-3-methylanthraquinone C10349 Frangulin B, analytical standard [ Show all ]
Inchi Key	AEQMIFRODRFTJF-SLFFLAALSA-N
Inchi ID	InChI=1S/C20H18O9/c1-8-2-10-14(12(22)3-8)17(25)15-11(16(10)24)4-9(5-13(15)23)29-19-18(26)20(27,6-21)7-28-19/h2-5,18-19,21-23,26-27H,6-7H2,1H3/t18-,19-,20+/m0/s1
PubChem CID	442744
ChEMBL	CHEMBL496999
IUPHAR	N/A
BindingDB	50269014
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
3757	P2Y purinoceptor 12	Q9H244	P2RY12	Homo sapiens (Human)	342

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