3-hydroxy-3-methyl-6-phosphohexanoic acid

Ligand id: 3202

Name: 3-hydroxy-3-methyl-6-phosphohexanoic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 124.87
Molecular weight 226.06
XLogP -1.32
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-hydroxy-3-methyl-6-phosphonohexanoic acid
Database Links
CAS Registry No. 63370-13-8 (source: Scifinder)
PubChem CID 23452327
Search Google for chemical match using the InChIKey XRCIRZGXKWCWNQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XRCIRZGXKWCWNQ
Search UniChem for chemical match using the InChIKey XRCIRZGXKWCWNQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone XRCIRZGXKWCWNQ
Comments
An isosteric analogue of (R)-5-phosphomevalonate [1].