名称: methyl(11R,12S,13E,15S)-9-(N-benzyloxycarbonylphenylalanyloxy)-11,15-bis(tert-butyldimethylsiloxy)-7-thiaprosta-8,13-dienoate
SMILES:
CCCCC[C@@H](/C=C/[C@@H]1C(SCCCCCC(=O)OC)=C(OC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)C[C@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)CMolecular Processing
Molecular formula
C49H77NO8SSi2
Molecular weight
896.39
Exact mass
895.4908
XLogP
12.68
TPSA
109.39
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
24
Heavy atoms
61
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.612
Molar refractivity
255.29
Supplementary Information
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