Y3P

(~{Z})-2-oxidanylbut-2-enedioic acid

Created: 2021-02-01
Last modified:  2021-02-17

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count12
Aromatic Bond Count0
2D diagram of Y3P

Chemical Component Summary

Name(~{Z})-2-oxidanylbut-2-enedioic acid
Systematic Name (OpenEye OEToolkits)(~{Z})-2-oxidanylbut-2-enedioic acid
FormulaC4 H4 O5
Molecular Weight132.072
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385OC(=O)C=C(O)C(O)=O
SMILESOpenEye OEToolkits2.0.7C(=C(C(=O)O)O)C(=O)O
Canonical SMILESCACTVS3.385 OC(=O)/C=C(O)/C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 C(=C(/C(=O)O)\O)\C(=O)O
InChIInChI1.03 InChI=1S/C4H4O5/c5-2(4(8)9)1-3(6)7/h1,5H,(H,6,7)(H,8,9)/b2-1-
InChIKeyInChI1.03 UWYVPFMHMJIBHE-UPHRSURJSA-N

Related Resource References

Resource NameReference
PubChem 54675764
ChEBI CHEBI:28394