MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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(2R)-2-hydroxy-2-methylbutanenitrile

MNXM114196 is deprecated and here replaced by MNXM726885
!!! Alternative mappings exist !!!

	Properties	Image
MNX_ID	MNXM726885
reference	chebi:60908
formula	C₅H₉NO
global charge	0
mol weight	99.133
InChIKey	VMEHOTODTPXCKT-RXMQYKEDSA-N
InChI	InChI=1S/C5H9NO/c1-3-5(2,7)4-6/h7H,3H2,1-2H3/t5-/m1/s1
SMILES	CC[C@@](C)(O)C#N

MNX internals

InChI (mnx)	InChI=1/C5H9NO/c1-3-5(2,7)4-6/h7H,3H2,1-2H3/t5-/m1/s1
SMILES (mnx)	[CH3:1][CH2:3][C@:5]([CH3:2])([C:4]#[N:6])[OH:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60908 chebi:60908 VMEHOTODTPXCKT-RXMQYKEDSA-N	(2R)-2-hydroxy-2-methylbutanenitrile (2R)-2-hydroxy-2-cyanobutane (2R)-2-hydroxy-2-methylbutyronitrile (R)-butan-2-one cyanohydrin 2-Hydroxy-2-methylbutanenitrile
hmdb:HMDB0060309 VMEHOTODTPXCKT-RXMQYKEDSA-N	(2R)-2-Hydroxy-2-methylbutanenitrile (2R)-2-Hydroxy-2-cyanobutane (2R)-2-Hydroxy-2-methylbutyronitrile (2R)-2-hydroxy-2-methylbutanenitrile (R)-Butan-2-one cyanohydrin (R)-butan-2-one cyanohydrin 2-Hydroxy-2-methylbutanenitrile
seed.compound:cpd20058 seedM:cpd20058 VMEHOTODTPXCKT-RXMQYKEDSA-N	(2R)-2-Hydroxy-2-methylbutanenitrile (2R)-2-hydroxy-2-methylbutanenitrile 2-Hydroxy-2-methylbutanenitrile
kegg.compound:C18796 keggC:C18796 VMEHOTODTPXCKT-RXMQYKEDSA-N	(2R)-2-Hydroxy-2-methylbutanenitrile 2-Hydroxy-2-methylbutanenitrile
metacyc.compound:CPD-12700 metacycM:CPD-12700 VMEHOTODTPXCKT-RXMQYKEDSA-N	(2S)-2-hydroxy-2-methylbutanenitrile
hmdb:HMDB60309 keggC:M_C18796 seedM:M_cpd20058	secondary/obsolete/fantasy identifier