Amicetin

Product description:Amicetin,an aminohexosepyrimidine nuleoside antibiotic,inhibited protein synthesis in intact cells and in cell-free extracts derived from these cells.
Synonyms: allomycin;scromycin
Molecular Formular:C29H42N6O9
Properties Computed from Structure:
Molecular Weight 618.67858 [g/mol] 
Molecular Formula C29H42N6O9 
XLogP -1.3 
H-Bond Donor 6 
H-Bond Acceptor 11 
Rotatable Bond Count 9 
Tautomer Count 11 
Exact Mass 618.301327 
MonoIsotopic Mass 618.301327 
Topological Polar Surface Area 209 
Heavy Atom Count 44 
Formal Charge 0 
Complexity 1110 
Isotope Atom Count 0 
Defined Atom StereoCenter Count 9 
Undefined Atom StereoCenter Count 0 
Defined Bond StereoCenter Count 0 
Undefined Bond StereoCenter Count 0 
Covalently-Bonded Unit Count 1
Descriptors Computed from Structure:
IUPAC Name: 4-[[(2S)-2-amino-3-hydroxy-2-methylpropanoyl]amino]-N-[1-[(2R,5S,
6R)-5-[(2R,3R,4S,5S,6R)-5-dimethylamino-3,
4-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-
yl]benzamide
Canonical SMILES: CC1C(CCC(O1)N2C=CC(=NC2=O)NC(=O)C3=CC=C(C=C3)NC(=O)C(C)(CO)N)OC4C(C(C(C
(O4)C)N(C)C)O)O
Isomeric SMILES: C[C@@H]1[C@H](CC[C@@H](O1)N2C=CC(=NC2=O)NC(=O)C3=CC=C(C=C3)NC(=O)[C@](C)
(CO)N)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C)N(C)C)O)O
InChI: InChI=1/C29H42N6O9/c1-15-19(44-26-24(38)23(37)22(34(4)5)16(2)43-26)10-
11-21(42-15)35-13-12-20(33-28(35)41)32-25(39)17-6-8-18(9-7-17)31-27(40)
29(3,30)14-36/h6-9,12-13,15-16,19,21-24,26,36-38H,10-11,14,30H2,1-5H3,
(H,31,40)(H,32,33,39,41)/t15-,16-,19+,21-,22-,23+,24-,26-,
29+/m1/s1/f/h31-32H