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

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cyclopentanone

	Properties	Image
MNX_ID	MNXM1658
reference	chebi:16486
formula	C₅H₈O
global charge	0
mol weight	84.118
InChIKey	BGTOWKSIORTVQH-UHFFFAOYSA-N
InChI	InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1-4H2
SMILES	O=C1CCCC1

MNX internals

InChI (mnx)	InChI=1/C5H8O/c6-5-3-1-2-4-5/h1-4H2
SMILES (mnx)	[CH2:1]1[CH2:2][CH2:4][C:5](=[O:6])[CH2:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16486 chebi:16486 BGTOWKSIORTVQH-UHFFFAOYSA-N	cyclopentanone Cyclopentanone ketocyclopentane ketopentamethylene oxocyclopentane
sabiork.compound:2094 sabiorkM:2094 kegg.compound:C00557 keggC:C00557 BGTOWKSIORTVQH-UHFFFAOYSA-N	Cyclopentanone
hmdb:HMDB0031407 BGTOWKSIORTVQH-UHFFFAOYSA-N	Cyclopentanone 3-Acetyl-6-methyl-pyran-2,4(3H)-dione Adipic ketone Adipinketon CP Dumasin Dumasine FEMA 3910 Ketocyclopentane Ketopentamethylene Oxocyclopentane cyclopentanone
seed.compound:cpd00436 seedM:cpd00436 vmhM:cpntn vmhmetabolite:cpntn BGTOWKSIORTVQH-UHFFFAOYSA-N	Cyclopentanone cyclopentanone
sabiork.compound:23242 sabiorkM:23242 BGTOWKSIORTVQH-UHFFFAOYSA-N	Cyclopetanone Cyclopentanone
envipath:...0cb069b8d367 envipathM:...0cb069b8d367 envipath:...a1ff8c1e2e71 envipathM:...a1ff8c1e2e71 BGTOWKSIORTVQH-UHFFFAOYSA-N	compound 0055839
metacyc.compound:CYCLOPENTANONE metacycM:CYCLOPENTANONE BGTOWKSIORTVQH-UHFFFAOYSA-N	cyclopentanone
hmdb:HMDB31407 chebi:14058 chebi:23496 chebi:4023 keggC:M_C00557 seedM:M_cpd00436 vmhM:M_cpntn	secondary/obsolete/fantasy identifier