AG00F9V6

6853-87-8 | S-Methyl-L-cysteine sulfoxide

AG00F9V6

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CAS Number	6853-87-8
Catalog Number	AG00F9V6(AGN-PC-0WAFZ8)
Chemical Name	S-Methyl-L-cysteine sulfoxide
IUPAC Name	(2R)-2-amino-3-methylsulfinylpropanoic acid
InChI	InChI=1S/C4H9NO3S/c1-9(8)2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-,9?/m0/s1
InChI Key	ZZLHPCSGGOGHFW-BUKSALPDSA-N
MDL Number	MFCD00152132
Molecular Formula	C4H9NO3S
Molecular Weight	151.1842
SMILES	[H][C@](N)(CS(C)=O)C(O)=O
Synonyms	kale anemia factor, methiin, methiin, (DL-Ala)-isomer, methiin, (L-Ala)-(R)-isomer, methiin, (L-Ala)-(S)-isomer, methiin, (L-Ala)-isomer, S-methyl-L-cysteinesulfoxide, S-methylcysteine sulfoxide, 6853-87-8, (2R)-2-Amino-3-(methylsulfinyl)propanoic acid, S-Methyl-L-cysteine sulfoxide, S-Methyl-L-Cysteine Sulphoxide, S-Methyl-L-Cysteine-S-oxide, S-Methylcysteine sulfoxide, S-Methylcysteine S-oxide, 4740-94-7, Alanine, 3-(methylsulfinyl)-, AK-78703, (methylsulfinyl)-D-alanine, AC1L4AA5, S-Methyl-L-cysteine S-oxide, 3-(methylsulfinyl)-L-alanine, SCHEMBL209225, CHEMBL464167, CTK1D1728, ANW-63651, BBL102294, FCH839860, MFCD00152132, STL556093, AKOS006273020, CM-1238, RTR-022903, DS-17496, AX8151243, TL8006594, (2R)-2-amino-3-methylsulfinylpropanoic acid, FT-0651603, ST24033970, Z1681, (2R)-2-Amino-3-methylsulfinyl-propanoic acid, (R)-2-amino-3-(methylsulfinyl)-propanoic acid, 853S878, I09-0595, (2R)-2-AMINO-3-METHANESULFINYLPROPANOIC ACID, Methiin, Methyiin, pyrolyzate, Kale anemia factor, Alanine,3- -, C4H9NO3S, S-Methyl-L-cysteinesulfoxide, S-Methylcysteine sulphoxide, L-Alanine, 3-(methylsulfinyl)-, C4-H9-N-O3-S, Alanine, 3-(methylsulfinyl)-, L-, S-Methylaptein sulfoxide, pyrolyzate, CID182092, S-Methyl-L-Cysteine Sulfoxide(SMCS), S-Methylcysteine sulfoxide, pyrolyzate, NSC 226572, L-Alanine, 3-(methylsulfinyl)- (9CI), Alanine, 3-(methylsulfinyl)-, L-, pyrolyzate, 32726-14-0,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	151.03g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	151.18g/mol
Monoisotopic Mass	151.03g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	99.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-4.3

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

Lot Number