Chem
J-GLOBAL ID：200907088962390360   Nikkaji number：J1.841.709J

2-[Bis(carboxymethyl)amino]-6-[[[1-[[(Z)-9-octadecenyloxy]methyl]-2-[(Z)-9-octadecenyloxy]ethoxy]acetyl]amino]hexanoic acid

2-[ビス(カルボキシメチル)アミノ]-6-[2-({1,3-ビス[(9Z)-オクタデカ-9-エン-1-イルオキシ]プロパン-2-イル}オキシ)アセトアミド]ヘキサン酸
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： C51H94N2O10
Molecular formula furigana： C51-H94-N2-O10
Molecular weight： 895.317
InChI： InChI=1S/C51H94N2O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-39-61-43-46(44-62-40-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)63-45-48(54)52-38-34-33-37-47(51(59)60)53(41-49(55)56)42-50(57)58/h17-20,46-47H,3-16,21-45H2,1-2H3,(H,52,54)(H,55,56)(H,57,58)(H,59,60)/b19-17-,20-18-
InChI key： XZAQERUGJJAGNO-CLFAGFIQSA-N
SMILES： CCCCCCCC/C=C\CCCCCCCCOCC(COCCCCCCCC/C=C\CCCCCCCC)OCC(=O)NCCCCC(N(CC(=O)O)CC(=O)O)C(=O)O
Systematic name  (4)：
  • 2-[ビス(カルボキシメチル)アミノ]-6-[[[1-[[(Z)-9-オクタデセニルオキシ]メチル]-2-[(Z)-9-オクタデセニルオキシ]エトキシ]アセチル]アミノ]ヘキサン酸
  • 2-[ビス(カルボキシメチル)アミノ]-6-[[2-[1-[[(Z)-9-オクタデセニルオキシ]メチル]-2-[(Z)-9-オクタデセニルオキシ]エトキシ]-1-オキソエチル]アミノ]ヘキサン酸
  • 2-[ビス(カルボキシメチル)アミノ]-6-[2-({1,3-ビス[(9Z)-オクタデカ-9-エン-1-イルオキシ]プロパン-2-イル}オキシ)アセトアミド]ヘキサン酸
  • 2-[bis(carboxymethyl)amino]-6-[2-({1,3-bis[(9Z)-octadec-9-en-1-yloxy]propan-2-yl}oxy)acetamido]hexanoic acid
Other name (2)：
  • 2-[Bis(carboxymethyl)amino]-6-[[[1-[[(Z)-9-octadecenyloxy]methyl]-2-[(Z)-9-octadecenyloxy]ethoxy]acetyl]amino]hexanoic acid
  • 2-[Bis(carboxymethyl)amino]-6-[[2-[1-[[(Z)-9-octadecenyloxy]methyl]-2-[(Z)-9-octadecenyloxy]ethoxy]-1-oxoethyl]amino]hexanoic acid
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