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VH0 : Summary
Code
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VH0
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One-letter code
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P
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Molecule name
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(2S,4S)-4-[4-(aminomethyl)-1,2,3-triazol-1-yl]pyrrolidine-2-carboxylic acid
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Systematic names
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Formula
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C8 H13 N5 O2
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Formal charge
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0
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Molecular weight
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211.221 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)C2NCC(n1nnc(c1)CN)C2 |
SMILES
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CACTVS |
3.385 |
NCc1cn(nn1)[CH]2CN[CH](C2)C(O)=O |
SMILES
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OpenEye OEToolkits |
1.9.2 |
c1c(nnn1C2CC(NC2)C(=O)O)CN |
Canonical SMILES
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CACTVS |
3.385 |
NCc1cn(nn1)[C@@H]2CN[C@@H](C2)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
1.9.2 |
c1c(nnn1[C@H]2C[C@H](NC2)C(=O)O)CN |
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IUPAC InChI | InChI=1S/C8H13N5O2/c9-2-5-4-13(12-11-5)6-1-7(8(14)15)10-3-6/h4,6-7,10H,1-3,9H2,(H,14,15)/t6-,7-/m0/s1 |
IUPAC InChI key | JFEVBUPMGGCXQM-BQBZGAKWSA-N |
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wwPDB Information |
Atom count
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28 (15 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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2013-04-23
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Last modified at
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2019-10-07
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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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