XIF

PIPERIDINE-3,4-DIOL

Created:	2000-08-17
Last modified:	2021-03-01

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3 entries where XIF is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	2
Bond Count	19
Aromatic Bond Count	0

2D diagram of XIF

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Chemical Component Summary
Name	PIPERIDINE-3,4-DIOL
Synonyms	XYLOSE-DERIVED ISOFAGOMINE
Systematic Name (OpenEye OEToolkits)	(3R,4R)-piperidine-3,4-diol
Formula	C₅ H₁₁ N O₂
Molecular Weight	117.146
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	OC1CCNCC1O
SMILES	CACTVS	3.370	O[CH]1CCNC[CH]1O
SMILES	OpenEye OEToolkits	1.7.6	C1CNCC(C1O)O
Canonical SMILES	CACTVS	3.370	O[C@@H]1CCNC[C@H]1O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C1CNC[C@H]([C@@H]1O)O
InChI	InChI	1.03	InChI=1S/C5H11NO2/c7-4-1-2-6-3-5(4)8/h4-8H,1-3H2/t4-,5-/m1/s1
InChIKey	InChI	1.03	IZXWMVPZODQBRB-RFZPGFLSSA-N

Related Resource References

Resource Name	Reference
PubChem	445613

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