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U6X : Summary
Code ![](/pdbe/static/images/help.png)
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U6X
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One-letter code ![](/pdbe/static/images/help.png)
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X
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Molecule name ![](/pdbe/static/images/help.png)
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Levosulpiride
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Systematic names ![](/pdbe/static/images/help.png)
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Formula ![](/pdbe/static/images/help.png)
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C15 H23 N3 O4 S
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Formal charge ![](/pdbe/static/images/help.png)
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0
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Molecular weight ![](/pdbe/static/images/help.png)
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341.426 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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CACTVS |
3.385 |
CCN1CCC[CH]1CNC(=O)c2cc(ccc2OC)[S](N)(=O)=O |
SMILES
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OpenEye OEToolkits |
2.0.7 |
CCN1CCCC1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N |
Canonical SMILES
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CACTVS |
3.385 |
CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)[S](N)(=O)=O |
Canonical SMILES
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OpenEye OEToolkits |
2.0.7 |
CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m0/s1 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | BGRJTUBHPOOWDU-NSHDSACASA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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46 (23 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Bound ligand
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Type description ![](/pdbe/static/images/help.png)
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non-polymer
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Type code ![](/pdbe/static/images/help.png)
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HETAIN
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Is modified ![](/pdbe/static/images/help.png)
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No
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Standard parent ![](/pdbe/static/images/help.png)
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Not Assigned
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Defined at ![](/pdbe/static/images/help.png)
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2023-05-19
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Last modified at ![](/pdbe/static/images/help.png)
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2024-05-10
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Status ![](/pdbe/static/images/help.png)
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Released
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Obsoleted ![](/pdbe/static/images/help.png)
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Not Assigned
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