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- ChemComp-DNO: D-mannose -

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Basic information

EntryDatabase: PDB chemical components / ID: DNO
NameName: D-mannose

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Chemical information

Composition
Formula: C6H12O6 / Number of atoms: 24 / Formula weight: 180.156 / Formal charge: 0
Others

3bdk

Type: D-saccharide / PDB classification: ATOMS / Three letter code: DNO / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3BDK
History
Create componentNov 19, 2007
Modify descriptorJun 4, 2011
Modify atom idJun 24, 2020
External linksUniChem / ChemSpider / Brenda / ChEBI / ChEMBL / CompTox / DrugBank / HMDB / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / 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 10.04O=CC(O)C(O)C(O)C(O)CO
CACTVS 3.341OC[CH](O)[CH](O)[CH](O)[CH](O)C=O
OpenEye OEToolkits 1.5.0C(C(C(C(C(C=O)O)O)O)O)O

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SMILES CANONICAL

CACTVS 3.341OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)C=O
OpenEye OEToolkits 1.5.0C([C@H]([C@H]([C@@H]([C@@H](C=O)O)O)O)O)O

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InChI

InChI 1.03InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4-,5-,6-/m1/s1

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InChIKey

InChI 1.03GZCGUPFRVQAUEE-KVTDHHQDSA-N

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SYSTEMATIC NAME

ACDLabs 10.04D-mannose
OpenEye OEToolkits 1.5.0(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal

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PDB entries

Showing all 4 items

PDB-2wku:
BIOSYNTHETIC THIOLASE FROM Z. RAMIGERA. THE N316H MUTANT.

PDB-2wl5:
BIOSYNTHETIC THIOLASE FROM Z. RAMIGERA. COMPLEX OF THE H348N MUTANT WITH COENZYME A.

PDB-3bdk:
Crystal Structure of Streptococcus suis mannonate dehydratase complexed with substrate analogue

PDB-8wbv:
The crystal structure of linear mannose with mutant H247F of the cellobiose 2-epimerase from Caldicellulosiruptor saccharolyticus

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