J8T

[(3~{R})-4-azanyl-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] dihydrogen phosphate

Created:	2019-02-11
Last modified:	2024-09-27

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1 entries where J8T is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	1
Bond Count	27
Aromatic Bond Count	0

2D diagram of J8T

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Chemical Component Summary
Name	[(3~{R})-4-azanyl-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] dihydrogen phosphate
Systematic Name (OpenEye OEToolkits)	[(3~{R})-4-azanyl-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] dihydrogen phosphate
Formula	C₆ H₁₄ N O₆ P
Molecular Weight	227.152
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CC(C)(CO[P](O)(O)=O)[CH](O)C(N)=O
SMILES	OpenEye OEToolkits	2.0.7	CC(C)(COP(=O)(O)O)C(C(=O)N)O
Canonical SMILES	CACTVS	3.385	CC(C)(CO[P](O)(O)=O)[C@@H](O)C(N)=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	CC(C)(COP(=O)(O)O)[C@H](C(=O)N)O
InChI	InChI	1.03	InChI=1S/C6H14NO6P/c1-6(2,4(8)5(7)9)3-13-14(10,11)12/h4,8H,3H2,1-2H3,(H2,7,9)(H2,10,11,12)/t4-/m0/s1
InChIKey	InChI	1.03	UUMQHJQLVJSTLV-BYPYZUCNSA-N

Related Resource References

Resource Name	Reference
PubChem	131750124

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