O=C(N[C@@H](Cc1ccccc1)[C@H](O)CN(OC1CCCCC1)S(=O)(=O)c1ccc(O)cc1)O[C@H]1CO[C@H]2OCC[C@H]21
SMILES: O=C(N[C@@H](Cc1ccccc1)[C@H](O)CN(OC1CCCCC1)S(=O)(=O)c1ccc(O)cc1)O[C@H]1CO[C@H]2OCC[C@H]21

Molecular Processing

Molecular formula
C29H38N2O9S
Molecular weight
590.7
Exact mass
590.2298
XLogP
3.11
TPSA
143.86
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
41
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.552
Molar refractivity
147.1

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→