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Yorodumi- ChemComp-MS5: 7-methoxy-2-(3-methoxybenzyl)-1,2,3,4-tetrahydroisoquinolin-6-yl ... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MS5 |
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Name | Name: Synonyms: 2-(3-methoxybenzyl)-6-O-sulfamoyl-7-methoxy-1,2,3,4-tetrahydroisoquinoline |
-Chemical information
Composition | Formula: C18H22N2O5S / Number of atoms: 48 / Formula weight: 378.443 / Formal charge: 0 | ||||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: MS5 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2WD2 | ||||||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / PubChem_TPharma / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.352 | OpenEye OEToolkits 1.6.1 | |
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-SMILES CANONICAL
CACTVS 3.352 | OpenEye OEToolkits 1.6.1 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.6.1 | [( | |
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-PDB entries
Showing all 1 items
PDB-2wd2:
A chimeric microtubule disruptor with efficacy on a taxane resistant cell line