Zinostatin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 66
Total Number of Articles : 85
PubChem 76632185
Molecular Formula

C35H35NO12

SMILES

CC1C(C(C(C(O1)OC2C3CC#CC4C(O4)(C#CC3=CC2OC(=O)C5=C(C=CC6=C5C=C(C=C6C)OC)O)C7COC(=O)O7)NC)O)O

InChI

InChI=1S/C35H35NO12/c1-16-12-19(42-4)14-22-20(16)8-9-23(37)27(22)32(40)45-24-13-18-10-11-35(26-15-43-34(41)46-26)25(48-35)7-5-6-21(18)31(24)47-33-28(36-3)30(39)29(38)17(2)44-33/h8-9,12-14,17,21,24-26,28-31,33,36-39H,6,15H2,1-4H3

synonyms
  • Neocarzinostatin
  • ZINOSTATIN
  • 9014-02-2
Click to show/hide the synonyms
Properties
Property Value
MW 661.6 g/mol
HBD 4
HBA 13
Rotatable Bond Count 8
Exact Mass 661.21592555 g/mol
Monoisotopic Mass 661.21592555 g/mol
Heavy Atom Count 48
Isotope Atom Count 0
Atom Stereo Count 11
Covalent Unit Count 1
Complexity 1460
xlogp 2.3
Topological Polar Surface Area 175