Chem
J-GLOBAL ID：200907090694450813
Nikkaji number：J1.465.849A
4,13,18,27,32-Pentadodecyl-41-(cyclohexyloxy)tridecacyclo[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
4,13,18,27,32-ペンタドデシル-41-(シクロヘキシルオキシ)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
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
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
Molecular formula： C108H148O
Molecular formula furigana： C108-H148-O
Molecular weight： 1462.371
InChI：
InChI=1S/C108H148O/c1-6-11-16-21-26-31-36-41-46-52-59-78-66-85-87-68-79(60-53-47-42-37-32-27-22-17-12-7-2)70-89-91-72-81(62-55-49-44-39-34-29-24-19-14-9-4)74-93-95-76-84(109-83-64-57-51-58-65-83)77-96-94-75-82(63-56-50-45-40-35-30-25-20-15-10-5)73-92-90-71-80(61-54-48-43-38-33-28-23-18-13-8-3)69-88-86(67-78)97(85)103-104(98(87)89)106(100(91)93)108(102(95)96)107(101(92)94)105(103)99(88)90/h66-77,83H,6-65H2,1-5H3
InChI key：
LMOPBXITZDHNIA-UHFFFAOYSA-N
SMILES：
CCCCCCCCCCCCc1cc2c3cc(CCCCCCCCCCCC)cc4c5cc(CCCCCCCCCCCC)cc6c7cc(OC8CCCCC8)cc8c9cc(CCCCCCCCCCCC)cc%10c%11cc(CCCCCCCCCCCC)cc%12c(c1)c2c1c(c34)c(c56)c(c78)c(c9%10)c1c%11%12
Systematic name (3)：
- 4,13,18,27,32-ペンタドデシル-41-(シクロヘキシルオキシ)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
- 6-(シクロヘキシルオキシ)-11,20,25,34,39-ペンタド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-(cyclohexyloxy)-11,20,25,34,39-pentadodecyltridecacyclo[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
- 4,13,18,27,32-Pentadodecyl-41-(cyclohexyloxy)tridecacyclo[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
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