SMILES:
CCCCC(=O)O[C@]1(C(=O)C(O)OC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21CMolecular Processing
Molecular formula
C48H71FN4O13
Molecular weight
931.11
Exact mass
930.5002
XLogP
4.06
TPSA
244.04
H-bond donors
5
H-bond acceptors
13
Rotatable bonds
15
Heavy atoms
66
Rings
5
Aromatic rings
0
Saturated rings
4
Aliphatic rings
5
Stereo centers
13
Undefined stereo
1
Formal charge
0
Heteroatoms
18
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
236.3
Supplementary Information
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