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J7D

Summary
Name:1-deoxy-1-[formyl(hydroxy)amino]-5-O-phosphono-D-ribitol
Formula:C6 H14 N O9 P
Formal charge:0
Formula weight:275.15 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-deoxy-1-[formyl(hydroxy)amino]-5-O-phosphono-D-ribitol
OpenEye OEToolkits2.0.6[(2~{R},3~{S},4~{S})-5-[methanoyl(oxidanyl)amino]-2,3,4-tris(oxidanyl)pentyl] dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OP(OCC(O)C(C(O)CN(O)C=O)O)(=O)O
InChIInChI1.03InChI=1S/C6H14NO9P/c8-3-7(12)1-4(9)6(11)5(10)2-16-17(13,14)15/h3-6,9-12H,1-2H2,(H2,13,14,15)/t4-,5+,6-/m0/s1
InChIKeyInChI1.03LBJFEFHCTYMJFD-JKUQZMGJSA-N
SMILES_CANONICALCACTVS3.385O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@@H](O)CN(O)C=O
SMILESCACTVS3.385O[CH](CO[P](O)(O)=O)[CH](O)[CH](O)CN(O)C=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C([C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)N(C=O)O
SMILESOpenEye OEToolkits2.0.6C(C(C(C(COP(=O)(O)O)O)O)O)N(C=O)O

221051

PDB entries from 2024-06-12

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