Chem
J-GLOBAL ID:200907069240436655
Nikkaji number:J1.780.153H
N-[2-(Methylphenylsulfonio)ethoxycarbonyl]-L-phenylalanine
N-[2-(メチルフェニルスルホニオ)エトキシカルボニル]-L-フェニルアラニン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C19 H22 NO4 [S+]
Molecular formula furigana:
C19-H22-N-O4-S
Molecular weight:
360.450
InChI:
InChI=1S/C19H21NO4S/c1-25(16-10-6-3-7-11-16)13-12-24-19(23)20-17(18(21)22)14-15-8-4-2-5-9-15/h2-11,17H,12-14H2,1H3,(H-,20,21,22,23)/p+1/t17-,25?/m0/s1
InChI key:
HJQGTHNICYAVIM-LFUZPPSTSA-O
SMILES:
C[S+](CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1ccccc1
Systematic name (4):
N-[[2-(メチルフェニルスルホニオ)エトキシ]カルボニル]-L-フェニルアラニン
N-[2-(メチルフェニルスルホニオ)エトキシカルボニル]-L-フェニルアラニン
[2-({[(1S)-1-カルボキシ-2-フェニルエチル]カルバモイル}オキシ)エチル](メチル)フェニルスルファニウム
[2-({[(1S)-1-carboxy-2-phenylethyl]carbamoyl}oxy)ethyl](methyl)phenylsulfanium
Other name (2):
N-[[2-(Methylphenylsulfonio)ethoxy]carbonyl]-L-phenylalanine
N-[2-(Methylphenylsulfonio)ethoxycarbonyl]-L-phenylalanine
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