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143673-92-1 | Glycine, 1,1'-(1,7-dioxo-1,7-heptanediyl)bis[glycyl-
CAS No: 143673-92-1 Catalog No: AG001I60 MDL No:
Product Description
Catalog Number:
AG001I60
Chemical Name:
Glycine, 1,1'-(1,7-dioxo-1,7-heptanediyl)bis[glycyl-
CAS Number:
143673-92-1
Molecular Formula:
C15H24N4O8
Molecular Weight:
388.3731
IUPAC Name:
2-[1,11-diamino-10-(carboxymethylideneamino)-2,10-dihydroxy-3,9-dioxoundecan-2-yl]iminoacetic acid
InChI:
InChI=1S/C15H24N4O8/c16-8-14(26,18-6-12(22)23)10(20)4-2-1-3-5-11(21)15(27,9-17)19-7-13(24)25/h6-7,26-27H,1-5,8-9,16-17H2,(H,22,23)(H,24,25)
InChI Key:
ZLDUGBDBIBRBKP-UHFFFAOYSA-N
SMILES:
NCC(C(=O)CCCCCC(=O)C(/N=C\C(=O)O)(CN)O)(N=CC(=O)O)O
Properties
Complexity:
569
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.159g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
388.377g/mol
Monoisotopic Mass:
388.159g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
226A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
2
XLogP3:
-7.6
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