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
Program | Version | Name |
ACDLabs | 12.01 | 2,4,6,8-tetrahydroxy-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetroxatetraphosphocane-2,4,6,8-tetrone |
OpenEye OEToolkits | 2.0.7 | 2,4,6,8-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
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O1P(O)(OP(O)(=O)OP(OP1(=O)O)(=O)O)=O |
InChI | InChI | 1.03 | InChI=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) |
InChIKey | InChI | 1.03 | GIXFALHDORQSOQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O[P]1(=O)O[P](O)(=O)O[P](O)(=O)O[P](O)(=O)O1 |
SMILES | CACTVS | 3.385 | O[P]1(=O)O[P](O)(=O)O[P](O)(=O)O[P](O)(=O)O1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | OP1(=O)OP(=O)(OP(=O)(OP(=O)(O1)O)O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | OP1(=O)OP(=O)(OP(=O)(OP(=O)(O1)O)O)O |