$CO/N=C1\C[C@H]2[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]2[C@@]2(C)C[C@@H](F)/C(=N/O[C@@H]3CCNC3)CC12.O=C(O)/C=C/C(=O)O$

SMILES: CO/N=C1\C[C@H]2[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]2[C@@]2(C)C[C@@H](F)/C(=N/O[C@@H]3CCNC3)CC12.O=C(O)/C=C/C(=O)O

Molecular Processing

Molecular formula

C28H42FN3O7

Molecular weight

551.66

Exact mass

551.3007

XLogP

3.4

TPSA

150.04

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.786

Molar refractivity

142.05

Supplementary Information

Details werden geladen…