MPD

(4S)-2-METHYL-2,4-PENTANEDIOL

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is present as a standalone ligand in 2,196 entries

as a non-polymer is covalently linked to polymer or other heterogen groups 16 entries

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Chemical Component Summary
Name	(4S)-2-METHYL-2,4-PENTANEDIOL
Identifiers	(4S)-2-methylpentane-2,4-diol
Formula	C₆ H₁₄ O₂
Molecular Weight	118.174
Type	NON-POLYMER
Isomeric SMILES	C[C@@H](CC(C)(C)O)O
InChI	InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3/t5-/m0/s1
InChIKey	SVTBMSDMJJWYQN-YFKPBYRVSA-N

Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	1
Bond Count	21
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB03564
Name	(4r)-2-Methylpentane-2,4-Diol
Groups	experimental
Synonyms	(4r)-2-Methylpentane-2,4-Diol

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Xylose isomerase	MNYQPTPEDRFTFGLWTVGWQGRDPFGDATRRALDPVESVRRLAELGAHG...	unknown
1-pyrroline-5-carboxylate dehydrogenase	MTVEPFRNEPIETFQTEEARRAMREALRRVREEFGRHYPLYIGGEWVDTK...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682