الاسم: [4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-2-methyl-but-2-enyloxymethyl]-phosphonic acid diisopropyl ester
SMILES:
COc1c(C)c2c(c(O)c1CC=C(C)COCP(=O)(OC(C)C)OC(C)C)C(=O)OC2Molecular Processing
Molecular formula
C22H33O8P
Molecular weight
456.47
Exact mass
456.1913
XLogP
4.89
TPSA
100.52
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
31
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.591
Molar refractivity
116.84
Supplementary Information
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