murrayacoumarin B

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 1
PubChem 10383752
Molecular Formula

C19H18O7

SMILES

CC1(C(O1)COC2=C(C3=C(C=C2)C=CC(=O)O3)O)CC4CC(=C)C(=O)O4

InChI

InChI=1S/C19H18O7/c1-10-7-12(24-18(10)22)8-19(2)14(26-19)9-23-13-5-3-11-4-6-15(20)25-17(11)16(13)21/h3-6,12,14,21H,1,7-9H2,2H3

synonyms
  • Murrayacoumarin B
  • 8-Hydroxy-7-[[3-methyl-3-[(4-methylidene-5-oxooxolan-2-yl)methyl]oxiran-2-yl]methoxy]chromen-2-one
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Properties
Property Value
MW 358.3 g/mol
HBD 1
HBA 7
Rotatable Bond Count 5
Exact Mass 358.10525291 g/mol
Monoisotopic Mass 358.10525291 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 656
xlogp 2.4
Topological Polar Surface Area 94.6