Cannabisin A

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1
Total Number of Articles : 1
PubChem 15086398
Molecular Formula

C34H30N2O8

SMILES

C1=CC(=CC=C1CCNC(=O)C2=C(C(=C3C=C(C(=CC3=C2)O)O)C4=CC(=C(C=C4)O)O)C(=O)NCCC5=CC=C(C=C5)O)O

InChI

InChI=1S/C34H30N2O8/c37-23-6-1-19(2-7-23)11-13-35-33(43)26-15-22-17-29(41)30(42)18-25(22)31(21-5-10-27(39)28(40)16-21)32(26)34(44)36-14-12-20-3-8-24(38)9-4-20/h1-10,15-18,37-42H,11-14H2,(H,35,43)(H,36,44)

synonyms
  • Cannabisin A
  • 130508-46-2
  • Cannabisim-a
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Properties
Property Value
MW 594.6 g/mol
HBD 8
HBA 8
Rotatable Bond Count 9
Exact Mass 594.20021592 g/mol
Monoisotopic Mass 594.20021592 g/mol
Heavy Atom Count 44
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 936
xlogp 5.1
Topological Polar Surface Area 180