AG003ONM

4857-44-7 | Calcium 2-hydroxy-4-(methylthio)butanoate

AG003ONM

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CAS Number	4857-44-7
Catalog Number	AG003ONM(AGN-PC-0S02S2)
Chemical Name	Calcium 2-hydroxy-4-(methylthio)butanoate
EC Number	225-455-4
IUPAC Name	calcium;2-hydroxy-4-methylsulfanylbutanoate
InChI	InChI=1S/2C5H10O3S.Ca/c2*1-9-3-2-4(6)5(7)8;/h2*4,6H,2-3H2,1H3,(H,7,8);/q;;+2/p-2
InChI Key	ABRVDWASZFDIEH-UHFFFAOYSA-L
MDL Number	MFCD00042725
Molecular Formula	C10H18CaO6S2
Molecular Weight	338.4543
SMILES	O=C([O-])C(O)CCSC.O=C([O-])C(O)CCSC.[Ca+2]
Synonyms	4857-44-7, Calcium 2-hydroxy-4-(methylthio)butanoate, Calcium 2-hydroxy-4-(methylthio)butyrate, OH-M, 2-Hydroxy-4-(methylthio)butyric acid calcium salt, Calcium bis(2-hydroxy-4-(methylthio)butyrate), DL-Methioninehydroxyanalog calcium, NSC 1230, EINECS 225-455-4, Butanoic acid, 2-hydroxy-4-(methylthio)-, calcium salt (2:1), Methionine hydroxy analogue calcium salt, 2-Hydroxy-4-(methylthio)butanoic acid calcium salt, Calcium alpha-hydroxy-gamma-methylmercaptobutyrate (VAN), AK109150, Butyric acid, 2-hydroxy-4-(methylthio)-, calcium salt (2:1), 922-50-9, calcium 2-hydroxy-4-methylsulfanylbutanoate, calcium hydroxymethionine, Methioninehydroxyanalog calcium, Desmeninol calcium, EINECS 213-075-1, ACMC-1BH8Q, AC1MS08R, C10H18CaO6S2, Calcium bis((1)-2-hydroxy-4-(methylthio)butyrate), AC1L31Z1, SCHEMBL1685415, Butanoic acid, 2-hydroxy-4-(methylthio)-, calcium salt, CTK8B1736, EBD8423, ABRVDWASZFDIEH-UHFFFAOYSA-L, DL-alpha-Hydroxymethionine calcium, BCP11942, Calcium alpha-Hydroxy-DL-methionine, KS-00000N2O, ANW-30673, Butanoic acid, 2-hydroxy-4-(methylthio)-, calcium salt (2:1) (9CI), AKOS015856197, ACM4857447, alpha-Hydroxy-DL-methionine Calcium Salt, 14676-91-6, AN-19083, AS-19364, BC650591, LS-48068, SY036367, calcium 2-hydroxy-4-(methylthio)-butyrate, AX8075601, DB-023004, TR-017703, calcium 2-hydroxy-4-methylsulfanyl-butanoate, FT-0651898, X7307, calcium 4-methylsulfanyl-2-oxidanyl-butanoate, MFCD00042725 (95%), A827558, 2-hydroxy-4-methylmercaptobutyric acid calcium salt, I14-6525, Desmeninol, UNII-1VK0YS654L, C5H10O3S.xCa, 1VK0YS654L, C5-H10-O3-S.x-Ca, C5H10O3S.1/2Ca, D,L-a-Hydroxymethionine Calcium, DL-Alpha Hydroxy Methionine Calcium, AR-1I1530, C5-H10-O3-S.1/2Ca, CID107344, H0651, Calcium salt of the hydroxy analogue of methionine, Calcium bis[(+-)-2-hydroxy-4-(methylthio)butyrate], MHA, Butanoic acid, 2-hydroxy-4-(methylthio)-, calcium salt (2:1), (.+.)-, 98033-68-2,

Complexity	88.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	338.017g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	338.446g/mol
Monoisotopic Mass	338.017g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	171A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number