이름: compound 20
SMILES:
CC1(C=C2Cc3c(cccc3-c3ccccc3-c3ccccc3)C2=O)CCCCC1Molecular Processing
Molecular formula
C29H28O
Molecular weight
392.54
Exact mass
392.214
XLogP
7.66
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.276
Molar refractivity
124.62
Supplementary Information
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