Chem
J-GLOBAL ID：200907014491113228   Nikkaji number：J1.901.347B

Bis[2-[bis[2-[[2-[bis[2-[[2-(acetylamino)ethyl]carbamoyl]ethyl]amino]ethyl]carbamoyl]ethyl]amino]ethyl] persulfide

ビス[2-[ビス[2-[[2-[ビス[2-[[2-(アセチルアミノ)エチル]カルバモイル]エチル]アミノ]エチル]カルバモイル]エチル]アミノ]エチル]ペルスルフィド
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： C80H148N26O20S2
Molecular formula furigana： C80-H148-N26-O20-S2
Molecular weight： 1858.350
InChI： InChI=1S/C80H148N26O20S2/c1-61(107)81-21-29-89-69(115)9-41-101(42-10-70(116)90-30-22-82-62(2)108)53-37-97-77(123)17-49-105(50-18-78(124)98-38-54-102(43-11-71(117)91-31-23-83-63(3)109)44-12-72(118)92-32-24-84-64(4)110)57-59-127-128-60-58-106(51-19-79(125)99-39-55-103(45-13-73(119)93-33-25-85-65(5)111)46-14-74(120)94-34-26-86-66(6)112)52-20-80(126)100-40-56-104(47-15-75(121)95-35-27-87-67(7)113)48-16-76(122)96-36-28-88-68(8)114/h9-60H2,1-8H3,(H,81,107)(H,82,108)(H,83,109)(H,84,110)(H,85,111)(H,86,112)(H,87,113)(H,88,114)(H,89,115)(H,90,116)(H,91,117)(H,92,118)(H,93,119)(H,94,120)(H,95,121)(H,96,122)(H,97,123)(H,98,124)(H,99,125)(H,100,126)
InChI key： LPJSBBXJZRDBLM-UHFFFAOYSA-N
SMILES： CC(=O)NCCNC(=O)CCN(CCNC(=O)CCN(CCSSCCN(CCC(=O)NCCN(CCC(=O)NCCNC(=O)C)CCC(=O)NCCNC(=O)C)CCC(=O)NCCN(CCC(=O)NCCNC(=O)C)CCC(=O)NCCNC(=O)C)CCC(=O)NCCN(CCC(=O)NCCNC(=O)C)CCC(=O)NCCNC(=O)C)CCC(=O)NCCNC(=O)C
Systematic name  (3)：
  • ビス[2-[ビス[2-[[2-[ビス[2-[[2-(アセチルアミノ)エチル]カルバモイル]エチル]アミノ]エチル]カルバモイル]エチル]アミノ]エチル]ペルスルフィド
  • N-{2-[ビス({2-[(2-アセトアミドエチル)カルバモイル]エチル})アミノ]エチル}-3-{[2-({2-[ビス({2-[(2-アセトアミドエチル)カルバモイル]エチル})アミノ]エチル}カルバモイル)エチル]({2-[(2-{ビス[2-({2-[ビス({2-[(2-アセトアミドエチル)カルバモイル]エチル})アミノ]エチル}カルバモイル)エチル]アミノ}エチル)ジスルファニル]エチル})アミノ}プロパンアミド
  • N-{2-[bis({2-[(2-acetamidoethyl)carbamoyl]ethyl})amino]ethyl}-3-{[2-({2-[bis({2-[(2-acetamidoethyl)carbamoyl]ethyl})amino]ethyl}carbamoyl)ethyl]({2-[(2-{bis[2-({2-[bis({2-[(2-acetamidoethyl)carbamoyl]ethyl})amino]ethyl}carbamoyl)ethyl]amino}ethyl)disulfanyl]ethyl})amino}propanamide
Other name (1)：
  • Bis[2-[bis[2-[[2-[bis[2-[[2-(acetylamino)ethyl]carbamoyl]ethyl]amino]ethyl]carbamoyl]ethyl]amino]ethyl] persulfide
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