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P0J

Summary
Name:2,4,6,8-tetrahydroxy-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetroxatetraphosphocane-2,4,6,8-tetrone
Formula:H4 O12 P4
Formal charge:0
Formula weight:319.92 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012,4,6,8-tetrahydroxy-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetroxatetraphosphocane-2,4,6,8-tetrone
OpenEye OEToolkits2.0.72,4,6,8-tetrakis(oxidanyl)-1,3,5,7,2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraoxatetraphosphocane 2,4,6,8-tetraoxide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O1P(O)(OP(O)(=O)OP(OP1(=O)O)(=O)O)=O
InChIInChI1.03InChI=1S/H4O12P4/c1-13(2)9-14(3,4)11-16(7,8)12-15(5,6)10-13/h(H,1,2)(H,3,4)(H,5,6)(H,7,8)
InChIKeyInChI1.03GIXFALHDORQSOQ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O[P]1(=O)O[P](O)(=O)O[P](O)(=O)O[P](O)(=O)O1
SMILESCACTVS3.385O[P]1(=O)O[P](O)(=O)O[P](O)(=O)O[P](O)(=O)O1
SMILES_CANONICALOpenEye OEToolkits2.0.7OP1(=O)OP(=O)(OP(=O)(OP(=O)(O1)O)O)O
SMILESOpenEye OEToolkits2.0.7OP1(=O)OP(=O)(OP(=O)(OP(=O)(O1)O)O)O

222415

PDB entries from 2024-07-10

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