N-16-Trimethylhemiasterlin
FEATURES
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NAMES
  • N-16-Trimethylhemiasterlin
SMILES
C/C(=C\[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)(C)c1cn(C)c2ccccc12)[N+](C)(C)C)C(C)(C)C)C(=O)O.[I-]
InChI
InChI=1S/C32H50N4O4.HI/c1-20(2)25(18-21(3)30(39)40)35(10)29(38)26(31(4,5)6)33-28(37)27(36(11,12)13)32(7,8)23-19-34(9)24-17-15-14-16-22(23)24;/h14-20,25-27H,1-13H3,(H-,33,37,39,40);1H/b21-18+;/t25-,26-,27-;/m1./s1
MOLECULAR FORMULA
C32H51IN4O4
CROSS REFERENCES
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N-16-Trimethylhemiasterlin
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight682.30
AlogP1.58
HBond donors2
HBond acceptors8
Atoms92
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by N-16-Trimethylhemiasterlin.