CC1CCC2(C)C(=CCC3C4CC(C)C(=O)C4(C)CCC32)C1
SMILES: CC1CCC2(C)C(=CCC3C4CC(C)C(=O)C4(C)CCC32)C1

Molecular Processing

Molecular formula
C21H32O
Molecular weight
300.49
Exact mass
300.2453
XLogP
5.4
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
22
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
7
Undefined stereo
7
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
90.42

Supplementary Information

Details werden geladen…

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