7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-(trideuteriomethyl)oct-1-enyl]-5-oxocyclopentyl]heptanoic acid


Chemical Name: 7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-(trideuteriomethyl)oct-1-enyl]-5-oxocyclopentyl]heptanoic acid
CAS Number: 112137-89-0
Product Number: AG008RK2(AGN-PC-00GA7Q)
Synonyms:
MDL No: MFCD00869984
Molecular Formula: C21H36O5
Molecular Weight: 368.5075

Identification/Properties


Computed Properties
Molecular Weight:
368.514g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
13
Exact Mass:
368.256g/mol
Monoisotopic Mass:
368.256g/mol
Topological Polar Surface Area:
94.8A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
473
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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