Name: crude desired product
SMILES:
COc1ccc2c3c1O[C@H]1C(=O)C[C@@H](C)[C@@]4(OC)[C@@H](C2)N(CC2CCC2)CC[C@]314Molecular Processing
Molecular formula
C24H31NO4
Molecular weight
397.52
Exact mass
397.2253
XLogP
3.12
TPSA
48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
6
Aromatic rings
1
Saturated rings
3
Aliphatic rings
5
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.708
Molar refractivity
108.64
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→