Name: N-tert-butoxycabonyl-2(R)-methyl-4(S)-hydroxy-5(S)-amino-7(S)-isopropyl-8-(3-hydroxyphenyl)-octanoic acid (N-butyl)-amide
SMILES:
CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](C[C@H](Cc1cccc(O)c1)C(C)C)NC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C27H46N2O5
Molecular weight
478.67
Exact mass
478.3407
XLogP
4.79
TPSA
107.89
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
13
Heavy atoms
34
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.704
Molar refractivity
135.62
Supplementary Information
Details werden geladen…
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