SMILES:
CCOC(=O)C(NCCCNC(=O)[C@@H](N)[C@@H](O)C(C)C)[C@@H](O)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=OMolecular Processing
Molecular formula
C26H41N5O12
Molecular weight
615.64
Exact mass
615.2752
XLogP
-2.97
TPSA
250.6
H-bond donors
6
H-bond acceptors
14
Rotatable bonds
15
Heavy atoms
43
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
8
Undefined stereo
1
Formal charge
0
Heteroatoms
17
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
147.22
Supplementary Information
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