G88

(2S)-2-(PHOSPHONOMETHYL)PENTANEDIOIC ACID

Created:2006-12-07
Last modified:  2011-06-04

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count1
Bond Count24
Aromatic Bond Count0
2D diagram of G88

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

Name(2S)-2-(PHOSPHONOMETHYL)PENTANEDIOIC ACID
Systematic Name (OpenEye OEToolkits)(2S)-2-(phosphonomethyl)pentanedioic acid
FormulaC6 H11 O7 P
Molecular Weight226.121
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P(O)(O)CC(C(=O)O)CCC(=O)O
SMILESCACTVS3.341OC(=O)CC[CH](C[P](O)(O)=O)C(O)=O
SMILESOpenEye OEToolkits1.5.0C(CC(=O)O)C(CP(=O)(O)O)C(=O)O
Canonical SMILESCACTVS3.341 OC(=O)CC[C@H](C[P](O)(O)=O)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C(CC(=O)O)[C@H](CP(=O)(O)O)C(=O)O
InChIInChI1.03 InChI=1S/C6H11O7P/c7-5(8)2-1-4(6(9)10)3-14(11,12)13/h4H,1-3H2,(H,7,8)(H,9,10)(H2,11,12,13)/t4-/m1/s1
InChIKeyInChI1.03 ISEYJGQFXSTPMQ-SCSAIBSYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL189217
PubChem 11085481
ChEMBL CHEMBL189217