COC(=O)[C@@H]1C[C@H](N=[N+]=[N-])C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
الاسم: 38
SMILES: COC(=O)[C@@H]1C[C@H](N=[N+]=[N-])C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C

Molecular Processing

Molecular formula
C21H25N3O6
Molecular weight
415.45
Exact mass
415.1743
XLogP
3.75
TPSA
131.57
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
102.65

Supplementary Information

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