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

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cyanate

	Properties	Image
MNX_ID	MNXM727224
reference	chebi:29195
formula	CNO
global charge	-1
mol weight	42.017
InChIKey	XLJMAIOERFSOGZ-UHFFFAOYSA-M
InChI	InChI=1S/CHNO/c2-1-3/h3H/p-1
SMILES	N#C[O-]

MNX internals

InChI (mnx)	InChI=1/CHNO/c2-1-3/h3H
SMILES (mnx)	[H][O:3][C:1]#[N:2]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	13
in models (compartimentalized)	9

Similar chemical compounds in external resources
Identifier	Description
CHEBI:29195 chebi:29195 XLJMAIOERFSOGZ-UHFFFAOYSA-M	cyanate Cyanat OCN(-) Zyanat [C(N)O](-) cyanate ion nitridooxidocarbonate(1-)
bigg.metabolite:cynt biggM:cynt envipath:...60706fcc3fa1 envipathM:...60706fcc3fa1 XLJMAIOERFSOGZ-UHFFFAOYSA-M	Cyanate
kegg.compound:C01417 keggC:C01417 XLJMAIOERFSOGZ-UHFFFAOYSA-N	Cyanate Cyanic acid
hmdb:HMDB0002078 XLJMAIOERFSOGZ-UHFFFAOYSA-N	Cyanate Cyanic acid Cyansaeure HOCN Zyansaeure [C(N)OH] cyanic acid
seed.compound:cpd01015 seedM:cpd01015 XLJMAIOERFSOGZ-UHFFFAOYSA-M	Cyanate Cyanic acid cyanate cyanic acid cynt hydrogen cyanate
vmhM:cynt vmhmetabolite:cynt XLJMAIOERFSOGZ-UHFFFAOYSA-M	Cyanate cyanic acid
metacyc.compound:CPD-69 metacycM:CPD-69 XLJMAIOERFSOGZ-UHFFFAOYSA-M	cyanate cyanic acid hydrogen cyanate
CHEBI:28024 chebi:28024 XLJMAIOERFSOGZ-UHFFFAOYSA-N	cyanic acid Cyanic acid Cyansaeure HOCN Zyansaeure [C(N)OH] acide cyanique acido cianico acidum cyanicum hydrogen nitridooxocarbonate hydroxidonitridocarbon nitridooxocarbonic acid
hmdb:HMDB02078 chebi:14037 chebi:23419 chebi:23422 chebi:3968 biggM:M_cynt keggC:M_C01417 seedM:M_cpd01015 vmhM:M_cynt	secondary/obsolete/fantasy identifier