Chem
J-GLOBAL ID：201007038129148860   Nikkaji number：J2.885.673C

2-Acetyl-9,10-bis[[[2-(dihydroxyboryl)benzyl](6-aminohexyl)amino]methyl]anthracene

2-アセチル-9,10-ビス[[[2-(ジヒドロキシボリル)ベンジル](6-アミノヘキシル)アミノ]メチル]アントラセン
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： C44H58B2N4O5
Molecular formula furigana： C44-H58-B2-N4-O5
Molecular weight： 744.590
InChI： InChI=1S/C44H58B2N4O5/c1-33(51)34-22-23-39-40(28-34)42(32-50(27-15-5-3-13-25-48)30-36-17-7-11-21-44(36)46(54)55)38-19-9-8-18-37(38)41(39)31-49(26-14-4-2-12-24-47)29-35-16-6-10-20-43(35)45(52)53/h6-11,16-23,28,52-55H,2-5,12-15,24-27,29-32,47-48H2,1H3
InChI key： YKGUKILJUGDJKR-UHFFFAOYSA-N
SMILES： CC(=O)c1ccc2c(CN(CCCCCCN)Cc3ccccc3B(O)O)c3ccccc3c(CN(CCCCCCN)Cc3ccccc3B(O)O)c2c1
Systematic name  (3)：
  • 2-アセチル-9,10-ビス[[[2-(ジヒドロキシボリル)ベンジル](6-アミノヘキシル)アミノ]メチル]アントラセン
  • [2-({[(3-アセチル-10-{[(6-アミノヘキシル)({[2-(ジヒドロキシボラニル)フェニル]メチル})アミノ]メチル}アントラセン-9-イル)メチル](6-アミノヘキシル)アミノ}メチル)フェニル]ボロン酸
  • [2-({[(3-acetyl-10-{[(6-aminohexyl)({[2-(dihydroxyboranyl)phenyl]methyl})amino]methyl}anthracen-9-yl)methyl](6-aminohexyl)amino}methyl)phenyl]boronic acid
Other name (1)：
  • 2-Acetyl-9,10-bis[[[2-(dihydroxyboryl)benzyl](6-aminohexyl)amino]methyl]anthracene
Thsaurus map：
Thesaurus Map

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