CCOC(=O)CC12C=CC(C(C)CCCC(C)C)C1(C)CCC1=C2CCC2CC(O)CCC12C
SMILES: CCOC(=O)CC12C=CC(C(C)CCCC(C)C)C1(C)CCC1=C2CCC2CC(O)CCC12C

Molecular Processing

Molecular formula
C31H50O3
Molecular weight
470.74
Exact mass
470.376
XLogP
7.63
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
34
Rings
4
Aromatic rings
0
Saturated rings
1
Aliphatic rings
4
Stereo centers
7
Undefined stereo
7
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.839
Molar refractivity
139.22

Supplementary Information

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