Chem
J-GLOBAL ID：200907027853666292   Nikkaji number：J406.538G

2,2′,2′′-[[(Propane-1,2,3-triyltrisoxy)tris(1-hexyl-12-oxo-3-dodecene-12,1-diyl)]trisoxy]tris(N,N-dimethyl-N-dodecyl-2-oxoethanaminium)

2,2′,2′′-[[(プロパン-1,2,3-トリイルトリスオキシ)トリス(1-ヘキシル-12-オキソ-3-ドデセン-12,1-ジイル)]トリスオキシ]トリス(N,N-ジメチル-N-ドデシル-2-オキソエタンアミニウム)
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： C105H200[N+]3O12
Molecular formula furigana： C105-H200-N3-O12
Molecular weight： 1696.762
InChI： InChI=1S/C105H200N3O12/c1-13-19-25-31-34-37-46-55-64-76-88-106(7,8)91-103(112)117-96(79-67-28-22-16-4)82-70-58-49-40-43-52-61-73-85-100(109)115-94-99(120-102(111)87-75-63-54-45-42-51-60-72-84-98(81-69-30-24-18-6)119-105(114)93-108(11,12)90-78-66-57-48-39-36-33-27-21-15-3)95-116-101(110)86-74-62-53-44-41-50-59-71-83-97(80-68-29-23-17-5)118-104(113)92-107(9,10)89-77-65-56-47-38-35-32-26-20-14-2/h58-60,70-72,96-99H,13-57,61-69,73-95H2,1-12H3/q+3
InChI key： AECONXHCQIPWMR-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCC[N+](C)(C)CC(=O)OC(CCCCCC)CC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC(CCCCCC)OC(=O)C[N+](C)(C)CCCCCCCCCCCC)OC(=O)CCCCCCCC=CCC(CCCCCC)OC(=O)C[N+](C)(C)CCCCCCCCCCCC
Systematic name  (3)：
  • 2,2′,2′′-[[(プロパン-1,2,3-トリイルトリスオキシ)トリス(1-ヘキシル-12-オキソ-3-ドデセン-12,1-ジイル)]トリスオキシ]トリス(N,N-ジメチル-N-ドデシル-2-オキソエタンアミニウム)
  • {2-[(18-{2,3-ビス[(12-{[2-(ドデシルジメチルアザニウミル)アセチル]オキシ}オクタデカ-9-エノイル)オキシ]プロポキシ}-18-オキソオクタデカ-9-エン-7-イル)オキシ]-2-オキソエチル}(ドデシル)ジメチルアザニウム
  • {2-[(18-{2,3-bis[(12-{[2-(dodecyldimethylazaniumyl)acetyl]oxy}octadec-9-enoyl)oxy]propoxy}-18-oxooctadec-9-en-7-yl)oxy]-2-oxoethyl}(dodecyl)dimethylazanium
Other name (1)：
  • 2,2′,2′′-[[(Propane-1,2,3-triyltrisoxy)tris(1-hexyl-12-oxo-3-dodecene-12,1-diyl)]trisoxy]tris(N,N-dimethyl-N-dodecyl-2-oxoethanaminium)
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM