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2389-86-8 | Ac-D-Arg-OH
CAS No: 2389-86-8 Catalog No: AG003SPW MDL No:
Product Description
Catalog Number:
AG003SPW
Chemical Name:
Ac-D-Arg-OH
CAS Number:
2389-86-8
Molecular Formula:
C8H16N4O3
Molecular Weight:
216.2376
IUPAC Name:
(2R)-2-acetamido-5-(diaminomethylideneamino)pentanoic acid;dihydrate
InChI:
InChI=1S/C8H16N4O3.2H2O/c1-5(13)12-6(7(14)15)3-2-4-11-8(9)10;;/h6H,2-4H2,1H3,(H,12,13)(H,14,15)(H4,9,10,11);2*1H2/t6-;;/m1../s1
InChI Key:
GCUXDHOAJIMUEB-QYCVXMPOSA-N
SMILES:
NC(=N)NCCC[C@H](C(=O)O)NC(=O)C
EC Number:
219-225-2
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
252.143g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
252.271g/mol
Monoisotopic Mass:
252.143g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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