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- ChemComp-J85: [[[bis(oxidanylmolybdenio)-$l^{3}-oxidanyl]-$l^{1}-oxidanyl-oxida... -

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Basic information

EntryDatabase: PDB chemical components / ID: J85
NameName: [[[bis(oxidanylmolybdenio)-$l^{3}-oxidanyl]-$l^{1}-oxidanyl-oxidanylidene-molybdenio]-(oxidanylmolybdenio)-$l^{3}-oxidanyl]-tetrakis($l^{1}-oxidanyl)molybdenum

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Chemical information

Composition
Formula: H3Mo5O11 / Number of atoms: 19 / Formula weight: 658.717 / Formal charge: 0
Others

6h8b

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: J85 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6H8B
History
Create componentFeb 9, 2019
Initial releaseFeb 20, 2019
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

CACTVS 3.385O.O.O.O.O.[Mo].O[Mo]O[Mo]O.O[Mo]O[Mo]=O
OpenEye OEToolkits 2.0.7O[Mo]O([Mo]O)[Mo](=O)([O])O([Mo]O)[Mo]([O])([O])([O])[O]

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SMILES CANONICAL

CACTVS 3.385O.O.O.O.O.[Mo].O[Mo]O[Mo]O.O[Mo]O[Mo]=O
OpenEye OEToolkits 2.0.7O[Mo]O([Mo]O)[Mo](=O)([O])O([Mo]O)[Mo]([O])([O])([O])[O]

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InChI

InChI 1.03InChI=1S/5Mo.8H2O.3O/h;;;;;8*1H2;;;/q4*+1;+4;;;;;;;;;;;/p-8

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InChIKey

InChI 1.03VWFFRZIWORKLLY-UHFFFAOYSA-F

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PDB entries

Showing all 1 items

PDB-6h8b:
Molybdenum storage protein prepared under in vivo-like conditions and incubated with ATP and molybdate at 303 K

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