Chem
J-GLOBAL ID：201107011044645726
Nikkaji number：J2.976.371B
(5R)-2-[(1S,2R)-1-Hydroxy-2-amino-3-oxo-3-hydroxypropyl]-5α-[(S)-2-(benzoylamino)-3-oxo-3-hydroxypropyl]-L-proline
(2R,5R)-2-[(1S,2R)-2-アミノ-2-カルボキシ-1-ヒドロキシエチル]-5-[(2S)-2-カルボキシ-2-(フェニルホルムアミド)エチル]ピロリジン-2-カルボン酸
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： C18H23N3O8
Molecular formula furigana： C18-H23-N3-O8
Molecular weight： 409.395
InChI：
InChI=1S/C18H23N3O8/c19-12(16(26)27)13(22)18(17(28)29)7-6-10(21-18)8-11(15(24)25)20-14(23)9-4-2-1-3-5-9/h1-5,10-13,21-22H,6-8,19H2,(H,20,23)(H,24,25)(H,26,27)(H,28,29)/t10-,11+,12-,13+,18-/m1/s1
InChI key：
DHAABZIWDYMYLT-YVHNNKAESA-N
SMILES：
N[C@H]([C@H](O)[C@]1(CC[C@H](C[C@H](NC(=O)c2ccccc2)C(=O)O)N1)C(=O)O)C(=O)O
Systematic name (3)：
- (5R)-2-[(1S,2R)-1-ヒドロキシ-2-アミノ-3-オキソ-3-ヒドロキシプロピル]-5α-[(S)-2-(ベンゾイルアミノ)-3-オキソ-3-ヒドロキシプロピル]-L-プロリン
- (2R,5R)-2-[(1S,2R)-2-アミノ-2-カルボキシ-1-ヒドロキシエチル]-5-[(2S)-2-カルボキシ-2-(フェニルホルムアミド)エチル]ピロリジン-2-カルボン酸
- (2R,5R)-2-[(1S,2R)-2-amino-2-carboxy-1-hydroxyethyl]-5-[(2S)-2-carboxy-2-(phenylformamido)ethyl]pyrrolidine-2-carboxylic acid
- (5R)-2-[(1S,2R)-1-Hydroxy-2-amino-3-oxo-3-hydroxypropyl]-5α-[(S)-2-(benzoylamino)-3-oxo-3-hydroxypropyl]-L-proline
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