이름: 2-methyl-11,12-dihydroxy-9,10-ethano-anthracene
SMILES:
Cc1ccc2c3c4ccccc4c(c2c1)C(O)C3OMolecular Processing
Molecular formula
C17H14O2
Molecular weight
250.3
Exact mass
250.0994
XLogP
3.38
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
19
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
76.11
Supplementary Information
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