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2MT : Summary
Code
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2MT
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One-letter code
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P
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Molecule name
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(4R)-2,2-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID
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Systematic names
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Formula
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C6 H11 N O2 S
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Formal charge
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0
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Molecular weight
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161.222 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
O=C(O)C1NC(SC1)(C)C |
SMILES
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CACTVS |
3.341 |
CC1(C)N[CH](CS1)C(O)=O |
SMILES
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OpenEye OEToolkits |
1.5.0 |
CC1(NC(CS1)C(=O)O)C |
Canonical SMILES
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CACTVS |
3.341 |
CC1(C)N[C@@H](CS1)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
CC1(N[C@@H](CS1)C(=O)O)C |
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IUPAC InChI | InChI=1S/C6H11NO2S/c1-6(2)7-4(3-10-6)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1 |
IUPAC InChI key | OCQICQZUUHJWGZ-BYPYZUCNSA-N |
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wwPDB Information |
Atom count
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21 (10 without Hydrogen)
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Polymer type
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Amino Acid
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Type description
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L-PEPTIDE LINKING
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Type code
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ATOMP
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Is modified
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Yes
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Standard parent
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PRO
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Defined at
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2004-02-16
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Last modified at
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2024-09-27
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Status
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Released
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Obsoleted
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Not Assigned
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