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

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The Swiss Initiative in Systems Biology

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propyl acetate

Properties

Image

Occurences in reactions

MNX_ID

MNXM130017

Image of MNXM130017

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

formula

C₅H₁₀O₂

charge

0

mass

102.06808

reference

InChIKey

YKYONYBAUNKHLG-UHFFFAOYSA-N

InChI

InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3

SMILES

CCCOC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:40116 chebi:40116	propyl acetate 1-acetoxypropane n-Propyl acetate propyl ethanoate
sabiork.compound:25511 sabiorkM:25511	Propyl acetate
hmdb:HMDB0034237	Propyl acetate 1-Acetoxypropane 1-Propyl acetate Acetic acid N-propyl ester Acetic acid, N-propyl ester Acetic acid, propyl ester Acetic acid,propyl ester N-Propyl acetate N-Propyl acetic acid N-Propyl ethanoate Propyl acetate, ion (1-) Propyl acetic acid Propyl ethanoate Propyl ethanoic acid propyl acetate
metacyc.compound:CPD-18998 metacycM:CPD-18998 seed.compound:cpd33154 seedM:cpd33154	propyl acetate
hmdb:HMDB34237 seedM:M_cpd33154	secondary/obsolete/fantasy identifier