Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

748384 - Overview - Compound Synopsis

Synonyms
BodyfolinC2F
LEVOMEFOLIC ACIDLMSR
Levomefolic AcidMetafolin
NutrifolinTHH
Molecular Formula
C20H25N7O6
InChI
InChI=1S/C20H25N7O6/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31)/t12-,13-/m0/s1
Smiles
CN1c2c([nH]c(N)nc2=O)NC[C@@H]1CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1
Cross References
UniChem655668
canSAR748384
PDBe (Protein Data Bank Europe)C2F
PDBe (Protein Data Bank Europe)THH
ChEMBLCHEMBL1231574
BindingDB50391007
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 459.18663152-0.257781358No


Compounds with the same scaffold


Image of compound ID: 748384
Murko Scaffold Family: 163 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12





Compound Lineages


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