Chem
J-GLOBAL ID：200907031138684418   Nikkaji number：J1.216.245F

Boc-L-Trp-[(4aR,5S)-Octahydro-2-benzyl-1,3-dioxo-1H-pyrido[1,2-c]pyrimidine-5-yl]NH2

Boc-L-Trp-[(4aR,5S)-オクタヒドロ-2-ベンジル-1,3-ジオキソ-1H-ピリド[1,2-c]ピリミジン-5-イル]NH2
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： C31H37N5O5
Molecular formula furigana： C31-H37-N5-O5
Molecular weight： 559.667
InChI： InChI=1S/C31H37N5O5/c1-31(2,3)41-29(39)34-25(16-21-18-32-23-13-8-7-12-22(21)23)28(38)33-24-14-9-15-35-26(24)17-27(37)36(30(35)40)19-20-10-5-4-6-11-20/h4-8,10-13,18,24-26,32H,9,14-17,19H2,1-3H3,(H,33,38)(H,34,39)/t24-,25-,26+/m0/s1
InChI key： JRSRZYFBWXHHNX-KKUQBAQOSA-N
SMILES： CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2[C@@H]1CC(=O)N(Cc1ccccc1)C2=O
Systematic name  (5)：
  • Boc-L-Trp-[(4aR,5S)-オクタヒドロ-2-ベンジル-1,3-ジオキソ-1H-ピリド[1,2-c]ピリミジン-5-イル]NH2
  • N-[(4aR,5S)-2-ベンジル-1,3-ジオキソオクタヒドロ-1H-ピリド[1,2-c]ピリミジン-5-イル]-Nα-(tert-ブトキシカルボニル)トリプトファンアミド
  • (4aR,5S)-2-ベンジル-5-[(tert-ブトキシカルボニル)トリプトフィルアミノ]-4,4a,5,6,7,8-ヘキサヒドロ-1H-ピリド[1,2-c]ピリミジン-1,3(2H)-ジオン
  • tert-ブチル N-[(1S)-1-{[(4aR,5S)-2-ベンジル-1,3-ジオキソ-オクタヒドロ-1H-ピリド[1,2-c]ピリミジン-5-イル]カルバモイル}-2-(1H-インドール-3-イル)エチル]カルバマート
  • tert-butyl N-[(1S)-1-{[(4aR,5S)-2-benzyl-1,3-dioxo-octahydro-1H-pyrido[1,2-c]pyrimidin-5-yl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamate
Other name (3)：
  • Boc-L-Trp-[(4aR,5S)-Octahydro-2-benzyl-1,3-dioxo-1H-pyrido[1,2-c]pyrimidine-5-yl]NH2
  • N-[(4aR,5S)-2-Benzyl-1,3-dioxooctahydro-1H-pyrido[1,2-c]pyrimidine-5-yl]-Nα-(tert-butoxycarbonyl)tryptophanamide
  • (4aR,5S)-2-Benzyl-5-[(tert-butoxycarbonyl)tryptophylamino]-4,4a,5,6,7,8-hexahydro-1H-pyrido[1,2-c]pyrimidine-1,3(2H)-dione
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