Chem
J-GLOBAL ID：200907044621896609   Nikkaji number：J2.069.279K

[Bis[2-[[2-[1,1-bis[[2-(ethoxycarbonyl)ethoxy]methyl]-2-[2-(ethoxycarbonyl)ethoxy]ethylamino]-2-oxoethyl]amino]ethyl]amino]acetic acid

[ビス[2-[[2-[1,1-ビス[[2-(エトキシカルボニル)エトキシ]メチル]-2-[2-(エトキシカルボニル)エトキシ]エチルアミノ]-2-オキソエチル]アミノ]エチル]アミノ]酢酸
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： C48H85N5O22
Molecular formula furigana： C48-H85-N5-O22
Molecular weight： 1084.221
InChI： InChI=1S/C48H85N5O22/c1-7-70-41(58)13-23-64-32-47(33-65-24-14-42(59)71-8-2,34-66-25-15-43(60)72-9-3)51-38(54)29-49-19-21-53(31-40(56)57)22-20-50-30-39(55)52-48(35-67-26-16-44(61)73-10-4,36-68-27-17-45(62)74-11-5)37-69-28-18-46(63)75-12-6/h49-50H,7-37H2,1-6H3,(H,51,54)(H,52,55)(H,56,57)
InChI key： PNRZZRCWYYHUIU-UHFFFAOYSA-N
SMILES： CCOC(=O)CCOCC(COCCC(=O)OCC)(COCCC(=O)OCC)NC(=O)CNCCN(CCNCC(=O)NC(COCCC(=O)OCC)(COCCC(=O)OCC)COCCC(=O)OCC)CC(=O)O
Systematic name  (3)：
  • [ビス[2-[[2-[1,1-ビス[[2-(エトキシカルボニル)エトキシ]メチル]-2-[2-(エトキシカルボニル)エトキシ]エチルアミノ]-2-オキソエチル]アミノ]エチル]アミノ]酢酸
  • 2-[ビス({2-[({[1,3-ビス(3-エトキシ-3-オキソプロポキシ)-2-[(3-エトキシ-3-オキソプロポキシ)メチル]プロパン-2-イル]カルバモイル}メチル)アミノ]エチル})アミノ]酢酸
  • 2-[bis({2-[({[1,3-bis(3-ethoxy-3-oxopropoxy)-2-[(3-ethoxy-3-oxopropoxy)methyl]propan-2-yl]carbamoyl}methyl)amino]ethyl})amino]acetic acid
Other name (1)：
  • [Bis[2-[[2-[1,1-bis[[2-(ethoxycarbonyl)ethoxy]methyl]-2-[2-(ethoxycarbonyl)ethoxy]ethylamino]-2-oxoethyl]amino]ethyl]amino]acetic acid
Thsaurus map：
Thesaurus Map

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