- octanal
- Charge: 0
- Formula: C8H16O
- Compartment: c - cytosol
- Universal Metabolite: octal
CHEBI:17935
- octanal
- Type: Small Molecule
- InChiKey: NUJGJRNETVAIRJ-UHFFFAOYSA-N
- View on ChEBI
Properties
- Molecular Mass||g/mol: 128.212[0], 128.0[1]
- SMILES: [H]C(=O)CCCCCCC[0], CCCCCCCC=O[1]
- Names: 1-Octanal[0,1], 1-Caprylaldehyde[0,1], 1-Octylaldehyde[0,1], 1-Octaldehyde[0,1], octanal[0,1], octan-1-al[0], caprylic aldehyde[0], n-caprylaldehyde[0], n-octyl aldehyde[0], n-octaldehyde[0], n-octanal[0,1], n-octylal[0], caprylaldehyde[0], aldehyde C-8[0], octanoic aldehyde[0], C-8 aldehyde[0], octylaldehyde[0], octanaldehyde[0], Caprylaldehyd[0], Kaprylaldehyd[0], Octylaldehyd[0], Oktylaldehyd[0], Oktanal[0], 1-caprylaldehyde[1], 1-octaldehyde[1], 1-octanal[1], 1-octylaldehyde[1]
Linkouts
- CHEBI: CHEBI:17935 [0]
- KEGG Compound: C01545 [0,1]
- MetaCyc Compound: CPD-371 [0,1]
- HMDB: HMDB0001140 [0]
- Wikipedia: Octanal [0]
- SEED Compound: cpd01088 [1]
- MetaNetX Chemical: MNXM2705 [1]
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:
A total of 49 (4.94%) metabolites are not produced by any reaction of the model: __iYO844__14bxyl_c, __iYO844__14glun_c, 1p3h5c_c, 4abutn_c, __iYO844__acmama_c, ...
Orphans are metabolites that are only consumed but not produced by reactions in the model. They may indicate the presence of network and knowledge gaps. Implementation: Find orphan metabolites structurally by considering only reaction equations and bounds. FBA is not carried out.
Reactions involving octal_c in iYO844
| BiGG ID | Name | Reference | Transport | Collection-specific | Model | |
|---|---|---|---|---|---|---|
| BiGG ID | Name | Reference | Transport | Collection-specific | Model |