COCC1CC(C(=O)OC2CCc3cc4c(cc3C2=O)OCc2cc(C(=O)COC(=O)C3CCC(C)N3C(=O)OC(C)(C)C)ccc2-4)N(C(=O)OC(C)(C)C)C1
SMILES: COCC1CC(C(=O)OC2CCc3cc4c(cc3C2=O)OCc2cc(C(=O)COC(=O)C3CCC(C)N3C(=O)OC(C)(C)C)ccc2-4)N(C(=O)OC(C)(C)C)C1

Molecular Processing

Molecular formula
C42H52N2O12
Molecular weight
776.88
Exact mass
776.352
XLogP
6.07
TPSA
164.28
H-bond donors
0
H-bond acceptors
12
Rotatable bonds
8
Heavy atoms
56
Rings
6
Aromatic rings
2
Saturated rings
2
Aliphatic rings
4
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
201.3

Supplementary Information

Details werden geladen…

An 1 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→