General
Preferred name
fumonisin B1
Synonyms
Fumonisin B1-13C34 ()
P&D ID
PD020883
CAS
116355-83-0
1217458-62-2
Tags
natural product
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
721.39
Hydrogen Bond Acceptors
12
Hydrogen Bond Donors
8
Rotatable Bonds
29
Ring Count
0
Aromatic Ring Count
0
cLogP
2.56
TPSA
288.51
Fraction CSP3
0.82
Chiral centers
10.0
Largest ring
0.0
QED
0.04
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
CERS1
Acyltransferase
Pathway
Metabolic Enzyme/Protease
Source data
