Q02

[(R)-amino(phenyl)methyl]phosphonic acid

Created:	2014-07-29
Last modified:	2015-03-25

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2 entries where Q02 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	1
Bond Count	22
Aromatic Bond Count	6

2D diagram of Q02

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Chemical Component Summary
Name	[(R)-amino(phenyl)methyl]phosphonic acid
Systematic Name (OpenEye OEToolkits)	[(R)-azanyl(phenyl)methyl]phosphonic acid
Formula	C₇ H₁₀ N O₃ P
Molecular Weight	187.133
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=P(O)(O)C(N)c1ccccc1
SMILES	CACTVS	3.385	N[CH](c1ccccc1)[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.9.2	c1ccc(cc1)C(N)P(=O)(O)O
Canonical SMILES	CACTVS	3.385	N[C@@H](c1ccccc1)[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.9.2	c1ccc(cc1)[C@H](N)P(=O)(O)O
InChI	InChI	1.03	InChI=1S/C7H10NO3P/c8-7(12(9,10)11)6-4-2-1-3-5-6/h1-5,7H,8H2,(H2,9,10,11)/t7-/m1/s1
InChIKey	InChI	1.03	ZKFNOUUKULVDOB-SSDOTTSWSA-N

Related Resource References

Resource Name	Reference
PubChem	1550365

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