Chem
J-GLOBAL ID：200907024792034361   Nikkaji number：J1.787.078E

ω-(2,2,5,7,8-Pentamethylchroman-6-ylsulfonyl)-L-Arg-Gly-O-tert-butyl-4-oxo-L-Hse-OH

ω-(2,2,5,7,8-ペンタメチルクロマン-6-イルスルホニル)-L-Arg-Gly-O-tert-ブチル-4-オキソ-L-Hse-OH
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： C30H48N6O9S
Molecular formula furigana： C30-H48-N6-O9-S
Molecular weight： 668.810
InChI： InChI=1S/C30H48N6O9S/c1-16-17(2)25(18(3)19-11-12-30(7,8)45-24(16)19)46(42,43)36-28(32)33-13-9-10-20(31)26(39)34-15-22(37)35-21(27(40)41)14-23(38)44-29(4,5)6/h20-21H,9-15,31H2,1-8H3,(H,34,39)(H,35,37)(H,40,41)(H3,32,33,36)/t20-,21-/m0/s1
InChI key： RDEFXOISMMQQHB-SFTDATJTSA-N
SMILES： Cc1c(C)c(c(C)c2CCC(C)(C)Oc12)S(=O)(=O)NC(=N)NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)O
Systematic name  (3)：
  • ω-(2,2,5,7,8-ペンタメチルクロマン-6-イルスルホニル)-L-Arg-Gly-O-tert-ブチル-4-オキソ-L-Hse-OH
  • (2S)-2-{2-[(2S)-2-アミノ-5-{N'-[(2,2,5,7,8-ペンタメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-6-イル)スルホニル]カルバムイミドアミド}ペンタンアミド]アセトアミド}-4-(tert-ブトキシ)-4-オキソブタン酸
  • (2S)-2-{2-[(2S)-2-amino-5-{N'-[(2,2,5,7,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)sulfonyl]carbamimidamido}pentanamido]acetamido}-4-(tert-butoxy)-4-oxobutanoic acid
Other name (1)：
  • ω-(2,2,5,7,8-Pentamethylchroman-6-ylsulfonyl)-L-Arg-Gly-O-tert-butyl-4-oxo-L-Hse-OH
Thsaurus map：
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