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110798-13-5 | D-Homoarginine
CAS No: 110798-13-5 Catalog No: AG003970 MDL No:
Product Description
Catalog Number:
AG003970
Chemical Name:
D-Homoarginine
CAS Number:
110798-13-5
Molecular Formula:
C7H16N4O2
Molecular Weight:
188.2275
IUPAC Name:
(2R)-2-amino-6-(diaminomethylideneamino)hexanoic acid
InChI:
InChI=1S/C7H16N4O2/c8-5(6(12)13)3-1-2-4-11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11)/t5-/m1/s1
InChI Key:
QUOGESRFPZDMMT-RXMQYKEDSA-N
SMILES:
NC(=N)NCCCC[C@H](C(=O)O)N
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
188.127g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
188.231g/mol
Monoisotopic Mass:
188.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.7
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