2PG
Summary
Name: | 2-PHOSPHOGLYCERIC ACID |
Formula: | C3 H7 O7 P |
Formal charge: | 0 |
Formula weight: | 186.057 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2R)-3-hydroxy-2-(phosphonooxy)propanoic acid |
OpenEye OEToolkits | 1.5.0 | (2R)-3-hydroxy-2-phosphonooxy-propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)OC(C(=O)O)CO |
SMILES_CANONICAL | CACTVS | 3.341 | OC[C@@H](O[P](O)(O)=O)C(O)=O |
SMILES | CACTVS | 3.341 | OC[CH](O[P](O)(O)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@H](C(=O)O)OP(=O)(O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(=O)O)OP(=O)(O)O)O |
InChI | InChI | 1.03 | InChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1 |
InChIKey | InChI | 1.03 | GXIURPTVHJPJLF-UWTATZPHSA-N |