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EAX : Summary
Code
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EAX
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One-letter code
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X
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Molecule name
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(2R,3R)-2,3,4-trihydroxybutanoic acid
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Synonyms
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erythronic acid
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Systematic names
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Formula
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C4 H8 O5
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Formal charge
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0
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Molecular weight
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136.103 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
O=C(O)C(O)C(O)CO |
SMILES
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CACTVS |
3.385 |
OC[CH](O)[CH](O)C(O)=O |
SMILES
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OpenEye OEToolkits |
1.9.2 |
C(C(C(C(=O)O)O)O)O |
Canonical SMILES
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CACTVS |
3.385 |
OC[C@@H](O)[C@@H](O)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.9.2 |
C([C@H]([C@H](C(=O)O)O)O)O |
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IUPAC InChI | InChI=1S/C4H8O5/c5-1-2(6)3(7)4(8)9/h2-3,5-7H,1H2,(H,8,9)/t2-,3-/m1/s1 |
IUPAC InChI key | JPIJQSOTBSSVTP-PWNYCUMCSA-N |
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wwPDB Information |
Atom count
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17 (9 without Hydrogen)
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Polymer type
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Bound ligand
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Type description
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NON-POLYMER
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Type code
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HETAIN
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Is modified
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No
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Standard parent
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Not Assigned
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Defined at
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2014-04-07
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Last modified at
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2021-03-01
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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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