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120693-52-9 | 4(1H)-Quinolinone, 1-methyl-2-(6Z,9Z)-6,9-pentadecadienyl-
CAS No: 120693-52-9 Catalog No: AG0075GL MDL No:
Product Description
Catalog Number:
AG0075GL
Chemical Name:
4(1H)-Quinolinone, 1-methyl-2-(6Z,9Z)-6,9-pentadecadienyl-
CAS Number:
120693-52-9
Molecular Formula:
C25H35NO
Molecular Weight:
365.5515
IUPAC Name:
1-methyl-2-pentadeca-6,9-dienylquinolin-4-one
InChI:
InChI=1S/C25H35NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-21-25(27)23-19-16-17-20-24(23)26(22)2/h7-8,10-11,16-17,19-21H,3-6,9,12-15,18H2,1-2H3
InChI Key:
ZVODRCBOPULJKJ-UHFFFAOYSA-N
SMILES:
CCCCC/C=C\C/C=C\CCCCCc1cc(=O)c2c(n1C)cccc2
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.272g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
365.561g/mol
Monoisotopic Mass:
365.272g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
7.7
Literature
| Title | Journal |
|---|---|
| Anti-inflammatory and anti-infectious effects of Evodia rutaecarpa (Wuzhuyu) and its major bioactive components. | Chinese medicine 20110101 |
| Quinolone alkaloids from evodiae fructus and their inhibitory effects on monoamine oxidase. | Archives of pharmacal research 20070401 |
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