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Yorodumi- ChemComp-LON: (7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: LON | ||||
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Name | Name: (Wikipedia | Wikipedia - Demecolcine: Demecolcine (INN; also known as colcemid) is a drug used in chemotherapy. It is closely related to the natural alkaloid colchicine with the replacement of the acetyl group on the amino moiety with methyl, but it is less toxic... | Comment | chemotherapy, alkaloid*YM | |
-Chemical information
Composition | Formula: C21H25NO5 / Number of atoms: 52 / Formula weight: 371.427 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: LON / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5XKE | ||||
History |
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External links | UniChem / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 | ( |
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-PDB entries
Showing all 1 items
PDB-5xke:
Crystal structure of T2R-TTL-Demecolcine complex