Nom: 1,2-dibenzyl 3-tert-butyl(2S,3S)-5-(2-methoxy-2-oxoethylidene)piperidine-1,2,3-tricarboxylate
SMILES:
COC(=O)C=C1C[C@H](C(=O)OC(C)(C)C)[C@@H](C(=O)OCc2ccccc2)N(C(=O)OCc2ccccc2)C1Molecular Processing
Molecular formula
C29H33NO8
Molecular weight
523.58
Exact mass
523.2206
XLogP
4.2
TPSA
108.44
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
137.41
Supplementary Information
Récupération des détails…
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