HG3
[(2~{R})-2,3,3-tris(oxidanyl)propyl] dihydrogen phosphate
Created: | 2016-08-11 |
Last modified: | 2017-01-18 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 1 |
Bond Count | 19 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | [(2~{R})-2,3,3-tris(oxidanyl)propyl] dihydrogen phosphate |
Systematic Name (OpenEye OEToolkits) | [(2~{R})-2,3,3-tris(oxidanyl)propyl] dihydrogen phosphate |
Formula | C3 H9 O7 P |
Molecular Weight | 188.073 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | OC(O)[CH](O)CO[P](O)(O)=O |
SMILES | OpenEye OEToolkits | 2.0.5 | C(C(C(O)O)O)OP(=O)(O)O |
Canonical SMILES | CACTVS | 3.385 | OC(O)[C@H](O)CO[P](O)(O)=O |
Canonical SMILES | OpenEye OEToolkits | 2.0.5 | C([C@H](C(O)O)O)OP(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C3H9O7P/c4-2(3(5)6)1-10-11(7,8)9/h2-6H,1H2,(H2,7,8,9)/t2-/m1/s1 |
InChIKey | InChI | 1.03 | TWWJQBIRJNUHBT-UWTATZPHSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 131206599 |