Zhang Lab

National University of Singapore

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

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	69984-73-2
Molecular formula	C15H30O6
IUPAC name	(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-nonoxyoxane-3,4,5-triol
Molecular weight	306.399
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	1.9
Synonyms	n-nonyl -d-glucopyranoside NONYL-beta-D-GLUCOPYRANOSIDE (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(nonyloxy)tetrahydro-2H-pyran-3,4,5-triol AKOS022171739 CHEMBL490225 GC1498 Nonyl -D-glucopyranoside SCHEMBL136394 4gbz B-Nonylglucoside MFCD00063300 Nonyl beta-D-glucopyranoside ZINC15609263 AC1L4EB7 C15H30O6 n-Nonyl -D-glucoside-(1,5);NGP Nonyl-beta-D-glucoside 50 mM Solution, 50 mM (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-nonoxyoxane-3,4,5-triol AX8257776 D0K1UI KB-206522 Nonyl ?-D-glucopyranoside SR-01000636074-1 beta-D-Glucopyranoside, nonyl MolPort-002-893-587 Nonyl beta-D-glucopyranoside, >=97.0% (GC) (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(nonyloxy)oxane-3,4,5-triol AK136208 CCG-46372 N-NONYL-BETA-D-GLUCOPYRANOSIDE Nonyl-I(2)-D-glucopyranoside 4gby b-D-Glucopyranoside, nonyl MCULE-5115555672 Nonyl b-D-glucopyranoside W0589 984N732 BNG [ Show all ]
Inchi Key	QFAPUKLCALRPLH-UXXRCYHCSA-N
Inchi ID	InChI=1S/C15H30O6/c1-2-3-4-5-6-7-8-9-20-15-14(19)13(18)12(17)11(10-16)21-15/h11-19H,2-10H2,1H3/t11-,12-,13+,14-,15-/m1/s1
PubChem CID	155448
ChEMBL	N/A
IUPHAR	N/A
BindingDB	N/A
DrugBank	DB02451
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
551336	Rhodopsin	P08100	RHO	Homo sapiens (Human)	348

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417