COC(=O)C(CO)NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O
الاسم: methyl (2S)-2-[[2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]amino]-3-hydroxypropanoate
SMILES: COC(=O)C(CO)NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

Molecular Processing

Molecular formula
C21H20N2O6
Molecular weight
396.4
Exact mass
396.1321
XLogP
0.54
TPSA
113.01
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
101.91

Supplementary Information

InChIKey: UPNYEQBBJCXNBF-BHWOMJMDSA-N
مرادفات
SCHEMBL9228473UPNYEQBBJCXNBF-BHWOMJMDSA-NN-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1- oxo-3-phenylpropyl]-L-serine, methyl esterN-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxo-3-phenylpropyl]-L-serine, methyl ester
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