Chem
J-GLOBAL ID:200907010505063789
Nikkaji number:J1.909.559B
2-Oxo-2-[4-[2-[[(2S)-2-[3-(bromoacetylamino)propionylamino]-3-hydroxypropionyl]amino]ethyl]anilino]acetic acid
[(4-{2-[(2S)-2-[3-(2-ブロモアセトアミド)プロパンアミド]-3-ヒドロキシプロパンアミド]エチル}フェニル)カルバモイル]ギ酸
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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:
C18 H23 BrN4 O7
Molecular formula furigana:
C18-H23-BR-N4-O7
Molecular weight:
487.307
InChI:
InChI=1S/C18H23BrN4O7/c19-9-15(26)20-8-6-14(25)23-13(10-24)16(27)21-7-5-11-1-3-12(4-2-11)22-17(28)18(29)30/h1-4,13,24H,5-10H2,(H,20,26)(H,21,27)(H,22,28)(H,23,25)(H,29,30)/t13-/m0/s1
InChI key:
IYAWTDCWUJJPHZ-ZDUSSCGKSA-N
SMILES:
OC[C@H](NC(=O)CCNC(=O)CBr)C(=O)NCCc1ccc(NC(=O)C(=O)O)cc1
Systematic name (3):
2-オキソ-2-[4-[2-[[(2S)-2-[3-(ブロモアセチルアミノ)プロピオニルアミノ]-3-ヒドロキシプロピオニル]アミノ]エチル]アニリノ]酢酸
[(4-{2-[(2S)-2-[3-(2-ブロモアセトアミド)プロパンアミド]-3-ヒドロキシプロパンアミド]エチル}フェニル)カルバモイル]ギ酸
[(4-{2-[(2S)-2-[3-(2-bromoacetamido)propanamido]-3-hydroxypropanamido]ethyl}phenyl)carbamoyl]formic acid
Other name (1):
2-Oxo-2-[4-[2-[[(2S)-2-[3-(bromoacetylamino)propionylamino]-3-hydroxypropionyl]amino]ethyl]anilino]acetic acid
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