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BDBM50097546 Sulfuric acidmono-{5-furan-3-yl-2-methyl-1-[1-(2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-ethyl]-pentyl}ester(sulfircin)

SMILES: C[C@H](CCCc1ccoc1)[C@@H](OS([O-])(=O)=O)C(C)[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C

InChI Key: InChIKey=RGCUPNSJAKXGJZ-BFLPCWMRSA-M

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50097546   
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
phosphatase Cdc25


(Homo sapiens (Human))		BDBM50097546
PNG
(Sulfuric acidmono-{5-furan-3-yl-2-methyl-1-[1-(2,5...)
Show SMILES C[C@H](CCCc1ccoc1)[C@@H](OS([O-])(=O)=O)C(C)[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C |c:21|
Show InChI InChI=1S/C26H42O5S/c1-18-11-12-22-25(4,5)14-8-15-26(22,6)23(18)20(3)24(31-32(27,28)29)19(2)9-7-10-21-13-16-30-17-21/h11,13,16-17,19-20,22-24H,7-10,12,14-15H2,1-6H3,(H,27,28,29)/p-1/t19-,20?,22+,23-,24-,26+/m1/s1
MMDB

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PC cid
PC sid
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Similars
PubMed
n/an/a 7.80E+3n/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Inhibitory activity tested against cell division cycle 25A (assay using fluorescein diphosphate (FDP) as substrate)

J Med Chem 44: 834-48 (2001)


BindingDB Entry DOI: 10.7270/Q2C82B14
More data for this
Ligand-Target Pair