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CASUARIIN
Chemical Formula :   C34H24O22
IUPAC Name :   (7S,8R,15R)-8-[(7R,8R)-1,2,3,8,13,14,15-heptahydroxy-5,11-dioxo-5? ,8,9,11-tetrahydro-7H-dibenzo[g,i][1,5]dioxacycloundecin-7-yl]-1,? 2,3,12,13,14,15-heptahydroxy-7,8-dihydro-4,7-methanodibenzo[f,h][?1,4]d ioxecine-5,10-dione
CAS Registry Number / CID :   cid-5315735
SMILES Notation :   C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)O
Molecular weight :   784.54116 [g/mol]
x log P :   -4.4
H Bond Donor :   22
H Bond Acceptor :   14 Molecular Structure
Rotatable bond count :   1 [Download]
Biological Activities Drug likeness / ADMET      
 
   
  Constituents (Alphabetical order)