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BDBM50250362 3-Oximo-olean-12-en-29-oic acid::CHEMBL490347

SMILES: CC1(C)C(CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)N=O

InChI Key: InChIKey=WINMXRJYKUPMJI-DEXHSINNSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50250362   
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
DNA polymerase beta


(Rattus norvegicus)
BDBM50250362
PNG
(3-Oximo-olean-12-en-29-oic acid | CHEMBL490347)
Show SMILES CC1(C)C(CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)N=O |r,t:17|
Show InChI InChI=1S/C30H47NO3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31-34)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23?,26+,27+,28-,29+,30+/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.60E+4n/an/an/an/an/an/a



University of Virginia Charlottesville

Curated by ChEMBL


Assay Description
Inhibition of rat DNA polymerase beta


J Nat Prod 62: 1110-3 (1999)


Article DOI: 10.1021/np990104r
BindingDB Entry DOI: 10.7270/Q2C8293M
More data for this
Ligand-Target Pair