Name: hemiacetal
SMILES:
CC(=O)N[C@H]1[C@H](O[C@@H]2[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](C)O[C@H]2O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OMolecular Processing
Molecular formula
C34H43NO13
Molecular weight
673.71
Exact mass
673.2734
XLogP
1.94
TPSA
174.38
H-bond donors
2
H-bond acceptors
13
Rotatable bonds
13
Heavy atoms
48
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
10
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
165.47
Supplementary Information
Details werden geladen…
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