baccharin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 16
Total Number of Articles : 8
PubChem 5874733
Molecular Formula

C29H38O11

SMILES

CC(C1/C=C\C=C/C(=O)OC2CC3C4(C2(C5(CCC6(C(C5O3)O6)C)COC(=O)C7C(O7)(C(CO1)O)C)C)CO4)O

InChI

InChI=1S/C29H38O11/c1-15(30)16-7-5-6-8-20(32)37-18-11-19-29(14-36-29)27(18,4)28(10-9-25(2)21(39-25)22(28)38-19)13-35-24(33)23-26(3,40-23)17(31)12-34-16/h5-8,15-19,21-23,30-31H,9-14H2,1-4H3/b7-5-,8-6-

synonyms
  • Baccharin
  • Trichothecene deriv.
  • 61251-97-6
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Properties
Property Value
MW 562.6 g/mol
HBD 2
HBA 11
Rotatable Bond Count 1
Exact Mass 562.24141202 g/mol
Monoisotopic Mass 562.24141202 g/mol
Heavy Atom Count 40
Isotope Atom Count 0
Atom Stereo Count 13
Covalent Unit Count 1
Complexity 1170
xlogp 0.5
Topological Polar Surface Area 149