Chem
J-GLOBAL ID：201407099469483130   Nikkaji number：J3.254.756G

[(2S)-2-[(Boc-L-Ala-)Amino]-5-(2-hydroxyethylthio)pentanoyl]-L-Phe-Gly-OMe

[(2S)-2-[(Boc-L-Ala-)アミノ]-5-(2-ヒドロキシエチルチオ)ペンタノイル]-L-Phe-Gly-OMe
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： C27H42N4O8S
Molecular formula furigana： C27-H42-N4-O8-S
Molecular weight： 582.710
InChI： InChI=1S/C27H42N4O8S/c1-18(29-26(37)39-27(2,3)4)23(34)30-20(12-9-14-40-15-13-32)25(36)31-21(16-19-10-7-6-8-11-19)24(35)28-17-22(33)38-5/h6-8,10-11,18,20-21,32H,9,12-17H2,1-5H3,(H,28,35)(H,29,37)(H,30,34)(H,31,36)/t18-,20-,21-/m0/s1
InChI key： AMPHIMBNMKTIJW-JBACZVJFSA-N
SMILES： COC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCSCCO)NC(=O)[C@H](C)NC(=O)OC(C)(C)C
Systematic name  (3)：
  • [(2S)-2-[(Boc-L-Ala-)アミノ]-5-(2-ヒドロキシエチルチオ)ペンタノイル]-L-Phe-Gly-OMe
  • メチル 2-[(2S)-2-[(2S)-2-[(2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}プロパンアミド]-5-[(2-ヒドロキシエチル)スルファニル]ペンタンアミド]-3-フェニルプロパンアミド]アセタート
  • methyl 2-[(2S)-2-[(2S)-2-[(2S)-2-{[(tert-butoxy)carbonyl]amino}propanamido]-5-[(2-hydroxyethyl)sulfanyl]pentanamido]-3-phenylpropanamido]acetate
Other name (1)：
  • [(2S)-2-[(Boc-L-Ala-)Amino]-5-(2-hydroxyethylthio)pentanoyl]-L-Phe-Gly-OMe
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM