P1V

(2~{S})-2-azanyl-6-(5-methyl-1~{H}-1,2,4-triazol-3-yl)hexanoic acid

Created:	2022-09-29
Last modified:	2024-09-27

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3 entries where P1V is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	1
Bond Count	31
Aromatic Bond Count	5

2D diagram of P1V

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Chemical Component Summary
Name	(2~{S})-2-azanyl-6-(5-methyl-1~{H}-1,2,4-triazol-3-yl)hexanoic acid
Systematic Name (OpenEye OEToolkits)	(2~{S})-2-azanyl-6-(5-methyl-1~{H}-1,2,4-triazol-3-yl)hexanoic acid
Formula	C₉ H₁₆ N₄ O₂
Molecular Weight	212.249
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1[nH]nc(CCCC[CH](N)C(O)=O)n1
SMILES	OpenEye OEToolkits	2.0.7	Cc1[nH]nc(n1)CCCCC(C(=O)O)N
Canonical SMILES	CACTVS	3.385	Cc1[nH]nc(CCCC[C@H](N)C(O)=O)n1
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1[nH]nc(n1)CCCC[C@@H](C(=O)O)N
InChI	InChI	1.06	InChI=1S/C9H16N4O2/c1-6-11-8(13-12-6)5-3-2-4-7(10)9(14)15/h7H,2-5,10H2,1H3,(H,14,15)(H,11,12,13)/t7-/m0/s1
InChIKey	InChI	1.06	BIBVPKMXAKDABB-ZETCQYMHSA-N

Related Resource References

Resource Name	Reference
PubChem	166449938

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