17-Oxa-4-azabicyclo[14.1.0]heptadecane-5,9-dione,7,11-dihydroxy-8,8,10,12,16-pentamethyl-3-[(1E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-, (1S,3S,7S,10R,11S,12S,16R)-


Chemical Name: 17-Oxa-4-azabicyclo[14.1.0]heptadecane-5,9-dione,7,11-dihydroxy-8,8,10,12,16-pentamethyl-3-[(1E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-, (1S,3S,7S,10R,11S,12S,16R)-
CAS Number: 219989-84-1
Product Number: AG00BE7K(AGN-PC-0QYIT9)
Synonyms:
MDL No:
Molecular Formula: C27H42N2O5S
Molecular Weight: 506.6978

Identification/Properties


Computed Properties
Molecular Weight:
506.702g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
506.281g/mol
Monoisotopic Mass:
506.281g/mol
Topological Polar Surface Area:
140A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
817
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
7
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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