Chem
J-GLOBAL ID:200907049846770754
Nikkaji number:J762.505G
2-[Nα -[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]-4,5,6,7-tetrahydrobenzothiazole
2-[Nα -[1-(N-メチル-D-フェニルアラニル)-L-プロリル]-L-アルギニル]-4,5,6,7-テトラヒドロベンゾチアゾール
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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:
C28 H39 N7 O3 S
Molecular formula furigana:
C28-H39-N7-O3-S
Molecular weight:
553.730
InChI:
InChI=1S/C28H39N7O3S/c1-31-21(17-18-9-3-2-4-10-18)27(38)35-16-8-13-22(35)25(37)33-20(12-7-15-32-28(29)30)24(36)26-34-19-11-5-6-14-23(19)39-26/h2-4,9-10,20-22,31H,5-8,11-17H2,1H3,(H,33,37)(H4,29,30,32)/t20-,21+,22-/m0/s1
InChI key:
PACZQPQCHDGDJM-BDTNDASRSA-N
SMILES:
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)c1nc2CCCCc2s1
Systematic name (3):
2-[Nα -[1-(N-メチル-D-フェニルアラニル)-L-プロリル]-L-アルギニル]-4,5,6,7-テトラヒドロベンゾチアゾール
(2S)-N-[(2S)-5-カルバムイミドアミド-1-オキソ-1-(4,5,6,7-テトラヒドロ-1,3-ベンゾチアゾール-2-イル)ペンタン-2-イル]-1-[(2R)-2-(メチルアミノ)-3-フェニルプロパノイル]ピロリジン-2-カルボキサミド
(2S)-N-[(2S)-5-carbamimidamido-1-oxo-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pentan-2-yl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide
Other name (1):
2-[Nα -[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]-4,5,6,7-tetrahydrobenzothiazole
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