N-[(3S,6S,7R,10S,14S,15S)-15-benzyl-10-[(2S)-butan-2-yl]-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide


Chemical Name: N-[(3S,6S,7R,10S,14S,15S)-15-benzyl-10-[(2S)-butan-2-yl]-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide
CAS Number: 22862-63-1
Product Number: AG00C4EJ(AGN-PC-03E5K7)
Synonyms:
MDL No:
Molecular Formula: C36H46N2O12
Molecular Weight: 698.7566

Identification/Properties


Computed Properties
Molecular Weight:
698.766g/mol
XLogP3:
5.8
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
8
Exact Mass:
698.305g/mol
Monoisotopic Mass:
698.305g/mol
Topological Polar Surface Area:
204A^2
Heavy Atom Count:
50
Formal Charge:
0
Complexity:
1200
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
7
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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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