COC1=CC(=O)[C@H]2C(OC)(OC)[C@]1(CC=C(C)C)C[C@H](O)[C@@]2(C)CCC=C(C)C
Name: 25
SMILES: COC1=CC(=O)[C@H]2C(OC)(OC)[C@]1(CC=C(C)C)C[C@H](O)[C@@]2(C)CCC=C(C)C

Molecular Processing

Molecular formula
C24H38O5
Molecular weight
406.56
Exact mass
406.2719
XLogP
4.56
TPSA
64.99
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
29
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.708
Molar refractivity
114.21

Supplementary Information

Details werden geladen…

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