2-Butenoic acid, 4-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-4-oxo-,(2R,4R,5S,6R)-tetrahydro-2-hydroxy-2-[(1S,2R,3S)-2-hydroxy-3-[(2R,3S,4E,6E,9S,10S,11R,12E,14Z)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxooxacyclohexadeca-4,6,12,14-tetraen-2-yl]-1-methylbutyl]-5-methyl-6-(1-methylethyl)-2H-pyran-4-yl ester, (2E)-


Chemical Name: 2-Butenoic acid, 4-[(2-hydroxy-5-oxo-1-cyclopenten-1-yl)amino]-4-oxo-,(2R,4R,5S,6R)-tetrahydro-2-hydroxy-2-[(1S,2R,3S)-2-hydroxy-3-[(2R,3S,4E,6E,9S,10S,11R,12E,14Z)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxooxacyclohexadeca-4,6,12,14-tetraen-2-yl]-1-methylbutyl]-5-methyl-6-(1-methylethyl)-2H-pyran-4-yl ester, (2E)-
CAS Number: 88899-56-3
Product Number: AG00GRSZ(AGN-PC-0VO5NO)
Synonyms:
MDL No: MFCD00214150
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
815.998g/mol
XLogP3:
5.9
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
12
Exact Mass:
815.446g/mol
Monoisotopic Mass:
815.446g/mol
Topological Polar Surface Area:
207A^2
Heavy Atom Count:
58
Formal Charge:
0
Complexity:
1670
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
11
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
5
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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