CC(C)=CCCC(O)C=C[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O
SMILES: CC(C)=CCCC(O)C=C[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O

Molecular Processing

Molecular formula
C21H34O4
Molecular weight
350.5
Exact mass
350.2457
XLogP
4.67
TPSA
74.6
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
12
Heavy atoms
25
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
100.37

Supplementary Information

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