BDBM50057030 (10R,11S,12R)-10-Ethyl-12-hydroxy-6,6,11-trimethyl-4-propyl-11,12-dihydro-6H,10H-dipyrano[2,3-f;2',3'-h]chromen-2-one::CHEMBL267693

SMILES: CCCc1cc(=O)oc2c3[C@H](O)[C@H](C)[C@@H](CC)Oc3c3C=CC(C)(C)Oc3c12

InChI Key: InChIKey=XOWABSPOTMPCPU-KPAZRMRSSA-N

Data: 1 EC50

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 = 50057030   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50057030 ((10R,11S,12R)-10-Ethyl-12-hydroxy-6,6,11-trimethyl...) Show SMILES CCCc1cc(=O)oc2c3[C@H](O)[C@H](C)[C@@H](CC)Oc3c3C=CC(C)(C)Oc3c12 |c:21| Show InChI InChI=1S/C23H28O5/c1-6-8-13-11-16(24)27-22-17(13)21-14(9-10-23(4,5)28-21)20-18(22)19(25)12(3)15(7-2)26-20/h9-12,15,19,25H,6-8H2,1-5H3/t12-,15-,19-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
MediChem Research, Inc. Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase using a poly(rC):oligo(dG)12-18 template primer				J Med Chem 40: 1005-17 (1997) Article DOI: 10.1021/jm960355m BindingDB Entry DOI: 10.7270/Q2N015NG
					More data for this Ligand-Target Pair