이름: tert-Butyl (5S,12S)-12-[(R)-[(3R,4R,5R)-3,4-bis{[tert-butyl(dimethyl)silyl]oxy}-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl](hydroxy)methyl]-5-isobutyl-3,6-dioxo-1-phenyl-2-oxa-4,7,11-triazatridecan-13-oate
SMILES:
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCN[C@H](C(=O)OC(C)(C)C)[C@@H](O)C1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)CMolecular Processing
Molecular formula
C44H75N5O11Si2
Molecular weight
906.28
Exact mass
905.5002
XLogP
5.72
TPSA
208.54
H-bond donors
5
H-bond acceptors
12
Rotatable bonds
19
Heavy atoms
62
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
7
Undefined stereo
1
Formal charge
0
Heteroatoms
18
Covalent units
1
Fraction Csp3
0.705
Molar refractivity
243.65
Supplementary Information
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