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150737-18-1 | Retinoic acid, 4-oxo-, 9-cis-
CAS No: 150737-18-1 Catalog No: AG001MTI MDL No:
Product Description
Catalog Number:
AG001MTI
Chemical Name:
Retinoic acid, 4-oxo-, 9-cis-
CAS Number:
150737-18-1
IUPAC Name:
(2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid
InChI:
InChI=1S/C20H26O3/c1-14(7-6-8-15(2)13-19(22)23)9-10-17-16(3)18(21)11-12-20(17,4)5/h6-10,13H,11-12H2,1-5H3,(H,22,23)/b8-6+,10-9+,14-7-,15-13+
InChI Key:
GGCUJPCCTQNTJF-NAXRMXIQSA-N
Properties
Complexity:
638
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4
Exact Mass:
314.188g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.425g/mol
Monoisotopic Mass:
314.188g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Retinoic acid and its 4-oxo metabolites are functionally active in human skin cells in vitro. | The Journal of investigative dermatology 20050701 |
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