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- ChemComp-Z5C: 5-(methoxymethyl)-1,2-oxazole-3-carboxamide -

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Basic information

EntryDatabase: PDB chemical components / ID: Z5C
NameName: 5-(methoxymethyl)-1,2-oxazole-3-carboxamide

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Chemical information

Composition
Formula: C6H8N2O3 / Number of atoms: 19 / Formula weight: 156.139 / Formal charge: 0
Others

7g8s

Type: non-polymer / PDB classification: HETAIN / Three letter code: Z5C / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7G8S
History
Create componentJun 22, 2023
Initial releaseJul 12, 2023
External linksUniChem / ChemSpider / PubChem / ZINC / 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 12.01O=C(N)c1cc(COC)on1
CACTVS 3.385COCc1onc(c1)C(N)=O
OpenEye OEToolkits 2.0.7COCc1cc(no1)C(=O)N

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SMILES CANONICAL

CACTVS 3.385COCc1onc(c1)C(N)=O
OpenEye OEToolkits 2.0.7COCc1cc(no1)C(=O)N

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InChI

InChI 1.06InChI=1S/C6H8N2O3/c1-10-3-4-2-5(6(7)9)8-11-4/h2H,3H2,1H3,(H2,7,9)

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InChIKey

InChI 1.06XJISISZPFKFZEU-UHFFFAOYSA-N

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SYSTEMATIC NAME

ACDLabs 12.015-(methoxymethyl)-1,2-oxazole-3-carboxamide
OpenEye OEToolkits 2.0.75-(methoxymethyl)-1,2-oxazole-3-carboxamide

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PDB entries

Showing all 3 items

PDB-7g8s:
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1270393711

PDB-7h47:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z1270393711 (A71EV2A-x0571)

PDB-7h6y:
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1270393711 (CHIKV_MacB-x0404)

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