F7Q

(2~{S})-2-azanyl-3-[1-(dioxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-yl]propanoic acid

Created:	2018-06-07
Last modified:	2024-09-27

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1 entries where F7Q is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	1
Bond Count	26
Aromatic Bond Count	0

2D diagram of F7Q

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Chemical Component Summary
Name	(2~{S})-2-azanyl-3-[1-(dioxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-yl]propanoic acid
Systematic Name (OpenEye OEToolkits)	(2~{S})-2-azanyl-3-[1-(dioxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-yl]propanoic acid
Formula	C₉ H₁₁ N O₅
Molecular Weight	213.187
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	N[CH](CC1(OO)C=CC(=O)C=C1)C(O)=O
SMILES	OpenEye OEToolkits	2.0.6	C1=CC(C=CC1=O)(CC(C(=O)O)N)OO
Canonical SMILES	CACTVS	3.385	N[C@@H](CC1(OO)C=CC(=O)C=C1)C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	C1=CC(C=CC1=O)(C[C@@H](C(=O)O)N)OO
InChI	InChI	1.03	InChI=1S/C9H11NO5/c10-7(8(12)13)5-9(15-14)3-1-6(11)2-4-9/h1-4,7,14H,5,10H2,(H,12,13)/t7-/m0/s1
InChIKey	InChI	1.03	ASMCASJKXVEEBU-ZETCQYMHSA-N

Related Resource References

Resource Name	Reference
PubChem	123629752

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