myriocin

Ligand id: 6664

Name: myriocin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 18
Topological polar surface area 141.08
Molecular weight 401.28
XLogP 0.12
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(E,2S,3R,4R)-2-amino-3,4-dihydroxy-2-(hydroxymethyl)-14-oxoicos-6-enoic acid
Synonyms
ISP-1 | thermozymocidin
Database Links
CAS Registry No. 35891-70-4 (source: Scifinder)
ChEMBL Ligand CHEMBL55076
PubChem CID 6438394
Search Google for chemical match using the InChIKey ZZIKIHCNFWXKDY-GNTQXERDSA-N
Search Google for chemicals with the same backbone ZZIKIHCNFWXKDY
Search UniChem for chemical match using the InChIKey ZZIKIHCNFWXKDY-GNTQXERDSA-N
Search UniChem for chemicals with the same backbone ZZIKIHCNFWXKDY
Wikipedia Myriocin
Comments
Myriocin is a sphingosine-like potent immunosuppressant acting primarily via inhibition of serine palmitoyltransferase which catalyses the first step of sphingolipid biosynthesis [1]. The compound was originally isolated from the fungus Isaria sinclarii.