Chem
J-GLOBAL ID:200907097551705084
Nikkaji number:J898.238D
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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:
C20 H30 N2 O5
Molecular formula furigana:
C20-H30-N2-O5
Molecular weight:
378.469
InChI:
InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16-/m0/s1
InChI key:
HLIAVLHNDJUHFG-HOTGVXAUSA-N
SMILES:
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NCCC(C)(C)C
Systematic name (5):
N-(3,3-ジメチルブチル)-L-Asp-L-Phe-OMe
N-(3,3-ジメチルブチル)-Asp-Phe-OMe
N-[N-(3,3-ジメチルブチル)-L-α-アスパルチル]-L-フェニルアラニン1-メチル
(3S)-3-[(3,3-ジメチルブチル)アミノ]-3-{[(2S)-1-メトキシ-1-オキソ-3-フェニルプロパン-2-イル]カルバモイル}プロパン酸
(3S)-3-[(3,3-dimethylbutyl)amino]-3-{[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}propanoic acid
Other name (8):
N-(3,3-Dimethylbutyl)-L-Asp-L-Phe-OMe
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N-(3,3-Dimethylbutyl)-Asp-Phe-OMe
N-[N-(3,3-Dimethylbutyl)-L-α-aspartyl]-L-phenylalanine 1-methyl ester
N-[N-(3,3-ジメチルブチル)L-α-アスパルチル]-L-フェニルアラニンメチル
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CAS registry number:
165450-17-9
Regulation number (1):
Application (1):
artificial sweetener
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