CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(CO2)SCC3=CC=C(C=C3)OC)O
الاسم: [(2S,3S,4S)-3-hydroxy-4-[(4-methoxyphenyl)methylsulfanyl]oxolan-2-yl]methyl 4-methylbenzenesulfonate
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(CO2)SCC3=CC=C(C=C3)OC)O

Molecular Processing

Molecular formula
C20H24O6S2
Molecular weight
424.54
Exact mass
424.1014
XLogP
2.77
TPSA
82.06
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
108.14

Supplementary Information

InChIKey: OOPSYUHUQXFVIP-UFYCRDLUSA-N
مرادفات
SCHEMBL8640355OOPSYUHUQXFVIP-UFYCRDLUSA-N1,4-Anhydro-2-S-[(4-methoxyphenyl)methyl]-2-thio-L-arabinitol 5-(4-Methylbenzenesulfonate)
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