Chem
J-GLOBAL ID:200907037803568929   Nikkaji number:J1.465.845I

N,N′-Diundecyl-13,18,32,41-tetradodecyltridecacyclo[36.4.0.02,7.06,11.08,37.09,22.010,15.016,21.020,25.023,36.024,29.030,35.034,39]dotetracontane-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-henicosene-4,27-diamine

N,N′-ジウンデシル-13,18,32,41-テトラドデシルトリデカシクロ[36.4.0.02,7.06,11.08,37.09,22.010,15.016,21.020,25.023,36.024,29.030,35.034,39]ドテトラコンタン-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-ヘニコサエン-4,27-ジアミン
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: C112H160N2
Molecular formula furigana: C112-H160-N2
Molecular weight: 1534.526
InChI: InChI=1S/C112H160N2/c1-7-13-19-25-31-37-41-47-53-59-65-83-71-89-90-72-84(66-60-54-48-42-38-32-26-20-14-8-2)76-94-99-81-88(114-70-64-58-52-46-36-30-24-18-12-6)82-100-96-78-86(68-62-56-50-44-40-34-28-22-16-10-4)74-92-91-73-85(67-61-55-49-43-39-33-27-21-15-9-3)77-95-98-80-87(113-69-63-57-51-45-35-29-23-17-11-5)79-97-93(75-83)101(89)107-108(102(90)94)112(106(99)100)110(104(92)96)109(103(91)95)111(107)105(97)98/h71-82,113-114H,7-70H2,1-6H3
InChI key: VLCQEFJLRMCZNY-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCc1cc2c3cc(CCCCCCCCCCCC)cc4c5cc(NCCCCCCCCCCC)cc6c7cc(CCCCCCCCCCCC)cc8c9cc(CCCCCCCCCCCC)cc%10c%11cc(NCCCCCCCCCCC)cc%12c(c1)c2c1c(c34)c(c56)c(c78)c(c9%10)c1c%11%12
Systematic name  (3):
  • N,N′-ジウンデシル-13,18,32,41-テトラドデシルトリデカシクロ[36.4.0.02,7.06,11.08,37.09,22.010,15.016,21.020,25.023,36.024,29.030,35.034,39]ドテトラコンタン-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-ヘニコサエン-4,27-ジアミン
  • 11,20,34,39-テトラドデシル-N6,N25-ジウンデシルトリデカシクロ[28.12.0.02,15.03,8.04,41.09,14.013,18.016,29.017,22.023,28.027,32.031,36.037,42]ドテトラコンタ-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-ヘンイコサエン-6,25-ジアミン
  • 11,20,34,39-tetradodecyl-N6,N25-diundecyltridecacyclo[28.12.0.02,15.03,8.04,41.09,14.013,18.016,29.017,22.023,28.027,32.031,36.037,42]dotetraconta-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-henicosaene-6,25-diamine
Other name (1):
  • N,N′-Diundecyl-13,18,32,41-tetradodecyltridecacyclo[36.4.0.02,7.06,11.08,37.09,22.010,15.016,21.020,25.023,36.024,29.030,35.034,39]dotetracontane-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-henicosene-4,27-diamine
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