Chem
J-GLOBAL ID:200907004821272705
Nikkaji number:J2.717.334I
10-Methoxy-27-[3,4,5-tris(dodecyloxy)benzyloxy]-3,7:8,12:13,17:20,24:25,29:30,34-hexametheno-1,2,18,19-tetraazacyclotetratriaconta-1,3,5,8,10,13,15,18,20,22,25,27,30,32-tetradecaene
10-メトキシ-27-[3,4,5-トリス(ドデシルオキシ)ベンジルオキシ]-3,7:8,12:13,17:20,24:25,29:30,34-ヘキサメテノ-1,2,18,19-テトラアザシクロテトラトリアコンタ-1,3,5,8,10,13,15,18,20,22,25,27,30,32-テトラデカエン
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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:
C80 H104 N4 O5
Molecular formula furigana:
C80-H104-N4-O5
Molecular weight:
1201.735
InChI:
InChI=1S/C80H104N4O5/c1-5-8-11-14-17-20-23-26-29-32-47-86-78-50-63(51-79(87-48-33-30-27-24-21-18-15-12-9-6-2)80(78)88-49-34-31-28-25-22-19-16-13-10-7-3)62-89-77-60-70-53-71(61-77)67-42-38-46-75(57-67)84-82-73-44-36-40-65(55-73)69-52-68(58-76(59-69)85-4)64-39-35-43-72(54-64)81-83-74-45-37-41-66(70)56-74/h35-46,50-61H,5-34,47-49,62H2,1-4H3/b83-81-,84-82-
InChI key:
YAGZMGLVLHHQJR-ACYTXRHASA-N
SMILES:
CCCCCCCCCCCCOc1cc(COc2cc3cc(c2)c2cccc(c2)/N=N\c2cccc(c2)c2cc(OC)cc(c2)c2cccc(c2)/N=N\c2cccc3c2)cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC
Systematic name (3):
10-メトキシ-27-[3,4,5-トリス(ドデシルオキシ)ベンジルオキシ]-3,7:8,12:13,17:20,24:25,29:30,34-ヘキサメテノ-1,2,18,19-テトラアザシクロテトラトリアコンタ-1,3,5,8,10,13,15,18,20,22,25,27,30,32-テトラデカエン
4-メトキシ-21-{[3,4,5-トリス(ドデシルオキシ)フェニル]メトキシ}-12,13,29,30-テトラアザヘプタシクロ[29.3.1.12,6 .17,11 .114,18 .119,23 .124,28 ]テトラコンタ-1(35),2,4,6(40),7,9,11(39),12,14,16,18(38),19,21,23(37),24,26,28(36),29,31,33-イコサエン
4-methoxy-21-{[3,4,5-tris(dodecyloxy)phenyl]methoxy}-12,13,29,30-tetraazaheptacyclo[29.3.1.12,6 .17,11 .114,18 .119,23 .124,28 ]tetraconta-1(35),2,4,6(40),7,9,11(39),12,14,16,18(38),19,21,23(37),24,26,28(36),29,31,33-icosaene
Other name (1):
10-Methoxy-27-[3,4,5-tris(dodecyloxy)benzyloxy]-3,7:8,12:13,17:20,24:25,29:30,34-hexametheno-1,2,18,19-tetraazacyclotetratriaconta-1,3,5,8,10,13,15,18,20,22,25,27,30,32-tetradecaene
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