5KO

(3R)-3-hydroxybutanal

Created:2015-10-13
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count14
Chiral Atom Count1
Bond Count13
Aromatic Bond Count0
2D diagram of 5KO

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Chemical Component Summary

Name(3R)-3-hydroxybutanal
SynonymsFaropenem adduct
Systematic Name (OpenEye OEToolkits)(3R)-3-oxidanylbutanal
FormulaC4 H8 O2
Molecular Weight88.105
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=CCC(C)O
SMILESCACTVS3.385C[CH](O)CC=O
SMILESOpenEye OEToolkits1.9.2CC(CC=O)O
Canonical SMILESCACTVS3.385 C[C@@H](O)CC=O
Canonical SMILESOpenEye OEToolkits1.9.2 C[C@H](CC=O)O
InChIInChI1.03 InChI=1S/C4H8O2/c1-4(6)2-3-5/h3-4,6H,2H2,1H3/t4-/m1/s1
InChIKeyInChI1.03 HSJKGGMUJITCBW-SCSAIBSYSA-N

Related Resource References

Resource NameReference
PubChem 13061653