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94125-79-8 | 4-Imidazolidineheptanoic acid, 3-[(2-cyclohexyl-2-oxoethylidene)amino]-2,5-dioxo-
CAS No: 94125-79-8 Catalog No: AG001S08 MDL No:
Product Description
Catalog Number:
AG001S08
Chemical Name:
4-Imidazolidineheptanoic acid, 3-[(2-cyclohexyl-2-oxoethylidene)amino]-2,5-dioxo-
CAS Number:
94125-79-8
Molecular Formula:
C18H27N3O5
Molecular Weight:
365.4241
IUPAC Name:
7-[3-[(E)-(2-cyclohexyl-2-oxoethylidene)amino]-2,5-dioxoimidazolidin-4-yl]heptanoic acid
InChI:
InChI=1S/C18H27N3O5/c22-15(13-8-4-3-5-9-13)12-19-21-14(17(25)20-18(21)26)10-6-1-2-7-11-16(23)24/h12-14H,1-11H2,(H,23,24)(H,20,25,26)/b19-12+
InChI Key:
XOVKWZIGMFIVIT-XDHOZWIPSA-N
SMILES:
O=C(C1CCCCC1)C=NN1C(=O)NC(=O)C1CCCCCCC(=O)O
Properties
Complexity:
569
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
365.195g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
365.43g/mol
Monoisotopic Mass:
365.195g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Prostaglandin D(2), its metabolite 15-d-PGJ(2), and peroxisome proliferator activated receptor-gamma agonists induce apoptosis in transformed, but not normal, human T lineage cells. | Immunology 20020101 |
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