AR7

amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium

Created:	2010-09-24
Last modified:	2024-09-27

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27 entries where AR7 is found in a polymer sequence

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Chemical Details
Formal Charge	1
Atom Count	29
Chiral Atom Count	1
Bond Count	28
Aromatic Bond Count	0

2D diagram of AR7

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Chemical Component Summary
Name	amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium
Systematic Name (OpenEye OEToolkits)	[azanyl-[[(4S)-4-azanyl-5,5-dihydroxy-pentyl]amino]methylidene]azanium
Formula	C₆ H₁₇ N₄ O₂
Molecular Weight	177.225
Type	PEPTIDE-LIKE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	OC(O)C(N)CCCN\C(=[NH2+])N
SMILES	CACTVS	3.370	N[CH](CCCNC(N)=[NH2+])C(O)O
SMILES	OpenEye OEToolkits	1.7.0	C(CC(C(O)O)N)CNC(=[NH2+])N
Canonical SMILES	CACTVS	3.370	N[C@@H](CCCNC(N)=[NH2+])C(O)O
Canonical SMILES	OpenEye OEToolkits	1.7.0	C(C[C@@H](C(O)O)N)CNC(=[NH2+])N
InChI	InChI	1.03	InChI=1S/C6H16N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4-5,11-12H,1-3,7H2,(H4,8,9,10)/p+1/t4-/m0/s1
InChIKey	InChI	1.03	GJQTZIGWTNAHJO-BYPYZUCNSA-O

Related Resource References

Resource Name	Reference
PubChem	137348943

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