AG007R98

1189-11-3 | (S)-2-Amino-5-(3-phosphonoguanidino)pentanoic acid

AG007R98

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CAS Number	1189-11-3
Catalog Number	AG007R98(AGN-PC-0NZPJM)
Chemical Name	(S)-2-Amino-5-(3-phosphonoguanidino)pentanoic acid
EC Number	214-714-7
IUPAC Name	(2S)-2-amino-5-[[amino-(phosphonoamino)methylidene]amino]pentanoic acid
InChI	InChI=1S/C6H15N4O5P/c7-4(5(11)12)2-1-3-9-6(8)10-16(13,14)15/h4H,1-3,7H2,(H,11,12)(H5,8,9,10,13,14,15)/t4-/m0/s1
InChI Key	CCTIOCVIZPCTGO-BYPYZUCNSA-N
MDL Number	MFCD09841186
Molecular Formula	C6H15N4O5P
Molecular Weight	254.1809
SMILES	O=C(O)[C@@H](N)CCCNC(NP(O)(O)=O)=N
Synonyms	arginine phosphate, phospho-L-arginine, phosphoarginine, 1189-11-3, Phospho-L-arginine, Phosphoarginine, N-Phospho-L-arginine, (S)-2-Amino-5-(3-phosphonoguanidino)pentanoic acid, phospho-arginine, Phosphoarginine A, N(omega)-Phospho-L-arginine, omega-N-Phosphoarginine, N5-[imino(phosphonoamino)methyl]L-ornithine, L-Arginine phosphate, L-Arginine-NG-phosphoric acid, N(omega)-phosphono-L-arginine, Arginine phosphate, N5-(Imino(phosphonoamino)methyl)L-ornithine, N(5)-[imino(phosphonoamino)methyl]-L-ornithine, (2S)-2-amino-5-{[imino(phosphonoamino)methyl]amino}pentanoic acid, omega-N-phospho-L-arginine, Phospho L-arginine, RPI, EINECS 214-714-7, alpha-amino-delta-phosphonoguanidinovaleric acid, Arginine phosphoric acid, AC1L3NIV, CHEBI:18412, ZINC1530092, MFCD09841186, AKOS022174911, AJ-26642, AX8282385, FT-0673858, C05945, (2S)-2-amino-5-[(N-phosphonocarbamimidoyl)amino]pentanoic acid, (2S)-2-amino-5-[[amino-(phosphonoamino)methylidene]amino]pentanoic acid, Phospho-L-arginine Trisodium Salt, C6H15N4O5P, CID92150, C6-H15-N4-O5-P, L-Ornithine, N5-[imino(phosphonoamino)methyl]-,

Complexity	314
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	254.078g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	6
Isotope Atom Count	0
Molecular Weight	254.183g/mol
Monoisotopic Mass	254.078g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	171A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-5.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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