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30986-62-0 | L-Arginine, 2,4-thiazolidinedicarboxylate (1:1)
CAS No: 30986-62-0 Catalog No: AG0031TW MDL No:MFCD00800362
Product Description
Catalog Number:
AG0031TW
Chemical Name:
L-Arginine, 2,4-thiazolidinedicarboxylate (1:1)
CAS Number:
30986-62-0
Molecular Formula:
C11H21N5O6S
Molecular Weight:
351.3793
MDL Number:
MFCD00800362
IUPAC Name:
(2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid;1,3-thiazolidine-2,4-dicarboxylic acid
InChI:
InChI=1S/C6H14N4O2.C5H7NO4S/c7-4(5(11)12)2-1-3-10-6(8)9;7-4(8)2-1-11-3(6-2)5(9)10/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);2-3,6H,1H2,(H,7,8)(H,9,10)/t4-;/m0./s1
InChI Key:
LUCWYYXUZVULSK-WCCKRBBISA-N
SMILES:
OC(=O)C1SCC(N1)C(=O)O.NC(=N)NCCC[C@@H](C(=O)O)N
EC Number:
250-417-9
UNII:
A9539XWW0P
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
351.121g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
351.378g/mol
Monoisotopic Mass:
351.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
240A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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