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

Feedback

3-nonenal

	Properties	Image
MNX_ID	MNXM114493
reference	chebi:195709
formula	C₉H₁₆O
global charge	0
mol weight	140.226
InChIKey	YXEAENVLZOODMT-VOTSOKGWSA-N
InChI	InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h6-7,9H,2-5,8H2,1H3/b7-6+
SMILES	CCCCC/C=C/CC=O

MNX internals

InChI (mnx)	InChI=1/C9H16O/c1-2-3-4-5-6-7-8-9-10/h6-7,9H,2-5,8H2,1H3/b7-6+
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:7]/[CH2:8][CH:9]=[O:10]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:195709 chebi:195709 YXEAENVLZOODMT-VOTSOKGWSA-N	3-nonenal (E)-non-3-enal
metacyc.compound:C-3-NONENAL metacycM:C-3-NONENAL YXEAENVLZOODMT-VOTSOKGWSA-N	(3E)-3-nonenal
hmdb:HMDB0303858 YXEAENVLZOODMT-VOTSOKGWSA-N	(E)-3-nonenal (3E)-non-3-enal 3-Nonenal 8-Nonenal Nonenal, (3Z)
lipidmaps:LMFA06000042 lipidmapsM:LMFA06000042 YXEAENVLZOODMT-VOTSOKGWSA-N	3-nonenal 3-nonenal FAL 9:1
seed.compound:cpd22476 seedM:cpd22476 YXEAENVLZOODMT-VOTSOKGWSA-N	c-3-nonenal (3E)-3-nonenal
seedM:M_cpd22476	secondary/obsolete/fantasy identifier