Name: (2RS,9aSR)-9a-butyl-2-(3-hydroxy-2-oxopropyl)-7-methoxymethoxy-4-methyl-1,2,9,9a-tetrahydro-3H-fluoren-3-one
SMILES:
CCCCC12Cc3cc(OCOC)ccc3C1=C(C)C(=O)C(CC(=O)CO)C2Molecular Processing
Molecular formula
C23H30O5
Molecular weight
386.49
Exact mass
386.2093
XLogP
3.72
TPSA
72.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
28
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.565
Molar refractivity
107.03
Supplementary Information
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