Chem
J-GLOBAL ID：200907037113361850
Nikkaji number：J2.112.668C
(2S)-2-Amino-3-[4-[(E)-3-hydroxy-3-methyl-1-butenyl]-1H-indole-3-yl]propanoic acid
(2S)-2-アミノ-3-[4-[(E)-3-ヒドロキシ-3-メチル-1-ブテニル]-1H-インドール-3-イル]プロパン酸
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
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
Molecular formula： C16H20N2O3
Molecular formula furigana： C16-H20-N2-O3
Molecular weight： 288.347
InChI：
InChI=1S/C16H20N2O3/c1-16(2,21)7-6-10-4-3-5-13-14(10)11(9-18-13)8-12(17)15(19)20/h3-7,9,12,18,21H,8,17H2,1-2H3,(H,19,20)/b7-6+/t12-/m0/s1
InChI key：
ZUAUKEREUMSQFY-SYTKJHMZSA-N
SMILES：
CC(C)(O)/C=C/c1cccc2[nH]cc(C[C@H](N)C(=O)O)c12
Systematic name (3)：
- (2S)-2-アミノ-3-[4-[(E)-3-ヒドロキシ-3-メチル-1-ブテニル]-1H-インドール-3-イル]プロパン酸
- (2S)-2-アミノ-3-{4-[(1E)-3-ヒドロキシ-3-メチルブタ-1-エン-1-イル]-1H-インドール-3-イル}プロパン酸
- (2S)-2-amino-3-{4-[(1E)-3-hydroxy-3-methylbut-1-en-1-yl]-1H-indol-3-yl}propanoic acid
- (2S)-2-Amino-3-[4-[(E)-3-hydroxy-3-methyl-1-butenyl]-1H-indole-3-yl]propanoic acid
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