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- ChemComp-FMP: FORMYCIN-5'-MONOPHOSPHATE -

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ID or keywords:

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Basic information

EntryDatabase: PDB chemical components / ID: FMP
NameName: formycin-5'-monophosphate

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Chemical information

Composition
Formula: C10H14N5O7P / Number of atoms: 37 / Formula weight: 347.221 / Formal charge: 0
Others

1ahb

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: FMP / Model coordinates PDB-ID: 1AHB
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
External linksUniChem / ChemSpider / Brenda / DrugBank / Nikkaji / PubChem / PubChem_TPharma / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=P(OCC3OC(c2nnc1c2ncnc1N)C(O)C3O)(O)O
CACTVS 3.341Nc1ncnc2c1[nH]nc2[CH]3O[CH](CO[P](O)(O)=O)[CH](O)[CH]3O
OpenEye OEToolkits 1.5.0c1nc2c(c(n1)N)[nH]nc2C3C(C(C(O3)COP(=O)(O)O)O)O

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SMILES CANONICAL

CACTVS 3.341Nc1ncnc2c1[nH]nc2[C@@H]3O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]3O
OpenEye OEToolkits 1.5.0c1nc2c(c(n1)N)[nH]nc2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O

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InChI

InChI 1.03InChI=1S/C10H14N5O7P/c11-10-6-4(12-2-13-10)5(14-15-6)9-8(17)7(16)3(22-9)1-21-23(18,19)20/h2-3,7-9,16-17H,1H2,(H,14,15)(H2,11,12,13)(H2,18,19,20)/t3-,7-,8-,9+/m1/s1

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InChIKey

InChI 1.03PBAHXXBYQACZMA-KSYZLYKTSA-N

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SYSTEMATIC NAME

ACDLabs 10.04(1S)-1-(7-amino-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-5-O-phosphono-D-ribitol
OpenEye OEToolkits 1.5.0[(2R,3S,4R,5S)-5-(7-amino-1H-pyrazolo[5,4-e]pyrimidin-3-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate

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PDB entries

Showing all 5 items

PDB-1ahb:
THE N-GLYCOSIDASE MECHANISM OF RIBOSOME-INACTIVATING PROTEINS IMPLIED BY CRYSTAL STRUCTURES OF ALPHA-MOMORCHARIN

PDB-1j1s:
Pokeweed Antiviral Protein from Seeds (PAP-S1) Complexed with Formycin

PDB-1pag:
THE 2.5 ANGSTROMS STRUCTURE OF POKEWEED ANTIVIRAL PROTEIN

PDB-1t8s:
Crystal Structure of E.coli AMP Nucleosidase complexed with formicin 5'-monophosphate

PDB-3rti:
Crystal structure of ricin bound with formycin monophosphate

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