200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 163564-92-9
163564-92-9 | 2H-Pyran-2-one, 5,6-dihydro-6-[(1E,3Z,5R,7E,9E,11R)-11-hydroxy-3,5,7-trimethyl-11-[(2S,4R,5S,6S)-tetrahydro-4-hydroxy-5-methyl-6-(1E)-1-propen-1-yl-2H-pyran-2-yl]-1,3,7,9-undecatetraen-1-yl]-, (6R)-
CAS No: 163564-92-9 Catalog No: AG001U8D MDL No:
Product Description
Catalog Number:
AG001U8D
Chemical Name:
2H-Pyran-2-one, 5,6-dihydro-6-[(1E,3Z,5R,7E,9E,11R)-11-hydroxy-3,5,7-trimethyl-11-[(2S,4R,5S,6S)-tetrahydro-4-hydroxy-5-methyl-6-(1E)-1-propen-1-yl-2H-pyran-2-yl]-1,3,7,9-undecatetraen-1-yl]-, (6R)-
CAS Number:
163564-92-9
Molecular Formula:
C28H40O5
Molecular Weight:
456.6142
IUPAC Name:
2-[11-hydroxy-11-(4-hydroxy-5-methyl-6-prop-1-enyloxan-2-yl)-3,5,7-trimethylundeca-1,3,7,9-tetraenyl]-2,3-dihydropyran-6-one
InChI:
InChI=1S/C28H40O5/c1-6-9-26-22(5)25(30)18-27(33-26)24(29)12-7-10-19(2)16-21(4)17-20(3)14-15-23-11-8-13-28(31)32-23/h6-10,12-15,17,21-27,29-30H,11,16,18H2,1-5H3
InChI Key:
CAYGMWMWJUFODP-UHFFFAOYSA-N
SMILES:
C/C=C/[C@@H]1O[C@@H](C[C@H]([C@@H]1C)O)[C@@H](/C=C/C=C(/C[C@H](/C=C(\C=C\[C@H]1CC=CC(=O)O1)/C)C)\C)O
Properties
Complexity:
816
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
456.288g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
456.623g/mol
Monoisotopic Mass:
456.288g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
7
Undefined Bond Stereocenter Count:
5
XLogP3:
5.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.