BindingDB logo
myBDB logout

null

SMILES: C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3

InChI Key: InChIKey=CKXRGSLEGLFLRZ-NWWXHUCFSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50428362   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Nitric oxide synthase, inducible


(Mus musculus (mouse))		BDBM50428362
PNG
(15-O-Acetylganolucidate A | CHEMBL2331733)
Show SMILES C[C@H](CC(=O)CC(C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3 |r,c:20|
Show InChI InChI=1S/C32H46O7/c1-17(13-20(34)14-18(2)28(37)38)22-15-26(39-19(3)33)32(8)21-9-10-24-29(4,5)25(36)11-12-30(24,6)27(21)23(35)16-31(22,32)7/h17-18,22,24,26H,9-16H2,1-8H3,(H,37,38)/t17-,18?,22-,24+,26+,30+,31-,32-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.90E+3n/an/an/an/an/an/a



National Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of iNOS-mediated nitric oxide production in LPS-stimulated mouse RAW264.7 cells after 24 hrs by Griess reaction analysis

J Nat Prod 76: 489-94 (2013)


Article DOI: 10.1021/np300443p
BindingDB Entry DOI: 10.7270/Q2PG1T1D
More data for this
Ligand-Target Pair