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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	Femring
Molecular formula	C20H26O3
IUPAC name	[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate
Molecular weight	314.425
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	2.8
Synonyms	17beta-Hydroxyestra-1,3,5(10)-trien-3-yl acetate beta-Estradiol 3-acetate DSSTox_GSID_45867 Estradiol 3-acetate NCGC00249885-01 3-Acetoxy-oestra-1,3,5(10)-trien-17beta-ol CHEMBL1200430 E 3A Estradiol, 3-acetate Tox21_113661 17beta-Estradiol 3-acetate 4245-41-4 Estra-1,3,5(10)-triene-3,17-diol, (17beta)-, 3-acetate FHXBMXJMKMWVRG-SLHNCBLASA-N 25975-62-6 CAS-4245-41-4 DSSTox_RID_81186 Estradiol acetate (USAN) SCHEMBL148561 3-Acetoxyestra-1,3,5(10)-trien-17beta-ol D04061 E3A Estradiol-3-acetate UNII-5R97F5H93P 17beta-Hydroxy-3-acetoxyestra-1,3,5(10)-triene 5R97F5H93P DSSTox_CID_25867 Estra-1,3,5(10)-triene-3,17beta-diyl 3-acetate Menoring 3-(Acetyloxy)estra-1,3,5(10)-trien-17.beta.-ol CHEBI:135981 DTXSID7045867 Estradiol acetate [USAN] Tox21_111359 3-O-Acetylestradiol D0T7ZQ Estra-1,3,5(10)-triene-3,17-diol, (17 beta)-, 3-acetate [ Show all ]
Inchi Key	FHXBMXJMKMWVRG-SLHNCBLASA-N
Inchi ID	InChI=1S/C20H26O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19+,20+/m1/s1
PubChem CID	9818306
ChEMBL	N/A
IUPHAR	N/A
BindingDB	N/A
DrugBank	DB13952
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
548810	G-protein coupled estrogen receptor 1	Q99527	GPER1	Homo sapiens (Human)	375

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