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- ChemComp-ACU: ACETALDEHYDE -

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Basic information

EntryDatabase: PDB chemical components / ID: ACU
Status

ACE

Status: Obsoleted / Replaced by: ACE
NameName: acetaldehyde

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Chemical information

Composition
Formula: C2H4O / Number of atoms: 7 / Formula weight: 44.053 / Formal charge: 0
OthersType: NON-POLYMER / PDB classification: HETAIN / Three letter code: ACU
History
Create componentJun 10, 2004
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=CC
CACTVS 3.341CC=O
OpenEye OEToolkits 1.5.0CC=O

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SMILES CANONICAL

CACTVS 3.341CC=O
OpenEye OEToolkits 1.5.0CC=O

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InChI

InChI 1.02bInChI=1/C2H4O/c1-2-3/h2H,1H3

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InChIKey

InChI 1.02bIKHGUXGNUITLKF-UHFFFAOYAB

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SYSTEMATIC NAME

ACDLabs 10.04acetaldehyde
OpenEye OEToolkits 1.5.0ethanal

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PDB entries

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