[(4R)-11-(3,5-dihydroxyphenyl)undecan-4-yl] 2-[(8R)-8-acetyloxyundecyl]-4,6-dihydroxybenzoate


Chemical Name: [(4R)-11-(3,5-dihydroxyphenyl)undecan-4-yl] 2-[(8R)-8-acetyloxyundecyl]-4,6-dihydroxybenzoate
CAS Number: 224186-03-2
Product Number: AG00BIIC(AGN-PC-0J1ZFW)
Synonyms:
MDL No:
Molecular Formula: C37H56O8
Molecular Weight: 628.8357

Identification/Properties


Computed Properties
Molecular Weight:
628.847g/mol
XLogP3:
11.4
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
25
Exact Mass:
628.398g/mol
Monoisotopic Mass:
628.398g/mol
Topological Polar Surface Area:
134A^2
Heavy Atom Count:
45
Formal Charge:
0
Complexity:
780
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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