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DGP : Summary
Code
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DGP
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One-letter code
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G
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Molecule name
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2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE
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Systematic names
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Formula
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C10 H14 N5 O7 P
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Formal charge
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0
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Molecular weight
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347.221 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
O=P(O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)CC3O |
SMILES
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CACTVS |
3.370 |
NC1=Nc2n(cnc2C(=O)N1)[CH]3C[CH](O)[CH](CO[P](O)(O)=O)O3 |
SMILES
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OpenEye OEToolkits |
1.7.0 |
c1nc2c(n1C3CC(C(O3)COP(=O)(O)O)O)N=C(NC2=O)N |
Canonical SMILES
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CACTVS |
3.370 |
NC1=Nc2n(cnc2C(=O)N1)[C@H]3C[C@H](O)[C@@H](CO[P](O)(O)=O)O3 |
Canonical SMILES
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OpenEye OEToolkits |
1.7.0 |
c1nc2c(n1[C@H]3C[C@@H]([C@H](O3)COP(=O)(O)O)O)N=C(NC2=O)N |
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IUPAC InChI | InChI=1S/C10H14N5O7P/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(22-6)2-21-23(18,19)20/h3-6,16H,1-2H2,(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1 |
IUPAC InChI key | LTFMZDNNPPEQNG-KVQBGUIXSA-N |
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wwPDB Information |
Atom count
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37 (23 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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Yes
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Standard parent
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DG
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Defined at
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1999-07-08
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Last modified at
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2019-03-01
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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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