Chaetocin


Chemical Name: Chaetocin
CAS Number: 28097-03-2
Product Number: AG00BEA7(AGN-PC-00BO57)
Synonyms:
MDL No: MFCD00133163
Molecular Formula: C30H28N6O6S4
Molecular Weight: 696.8399

Identification/Properties


Computed Properties
Molecular Weight:
696.83g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
3
Exact Mass:
696.095g/mol
Monoisotopic Mass:
696.095g/mol
Topological Polar Surface Area:
247A^2
Heavy Atom Count:
46
Formal Charge:
0
Complexity:
1400
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
Undefined Atom Stereocenter Count:
0
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


Other Analytical Data


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