Name: 4,5α-epoxy-3-methoxy-14β-(3-phenylpropyloxy)morphinan-6-one hydrochloride
SMILES:
COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(OCCCc5ccccc5)[C@@H](C2)NCC[C@]314.ClMolecular Processing
Molecular formula
C26H30ClNO4
Molecular weight
455.98
Exact mass
455.1863
XLogP
3.78
TPSA
56.79
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
32
Rings
6
Aromatic rings
2
Saturated rings
2
Aliphatic rings
4
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.5
Molar refractivity
124.13
Supplementary Information
Details werden geladen…
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