VON

(3~{S},4~{S},5~{S},6~{R})-4,5,6-tris(oxidanyl)piperidine-3-carboxylic acid

Created: 2023-03-21
Last modified:  2024-01-10

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count4
Bond Count23
Aromatic Bond Count0
2D diagram of VON

Chemical Component Summary

Name(3~{S},4~{S},5~{S},6~{R})-4,5,6-tris(oxidanyl)piperidine-3-carboxylic acid
Systematic Name (OpenEye OEToolkits)(3~{S},4~{S},5~{S},6~{R})-4,5,6-tris(oxidanyl)piperidine-3-carboxylic acid
FormulaC6 H11 N O5
Molecular Weight177.155
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385O[CH]1NC[CH]([CH](O)[CH]1O)C(O)=O
SMILESOpenEye OEToolkits2.0.7C1C(C(C(C(N1)O)O)O)C(=O)O
Canonical SMILESCACTVS3.385 O[C@H]1NC[C@@H]([C@H](O)[C@@H]1O)C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 C1[C@@H]([C@@H]([C@@H]([C@H](N1)O)O)O)C(=O)O
InChIInChI1.06 InChI=1S/C6H11NO5/c8-3-2(6(11)12)1-7-5(10)4(3)9/h2-5,7-10H,1H2,(H,11,12)/t2-,3-,4-,5+/m0/s1
InChIKeyInChI1.06 ZIPHSWANMLXHEB-NEEWWZBLSA-N

Related Resource References

Resource NameReference
PubChem 53241596