Chem
J-GLOBAL ID:200907065722142629
Nikkaji number:J1.777.651G
14,17,20,23,26,29-Hexakis[4-[2-[2-(2-ethoxyethoxy)ethoxymethyl]-3-[2-(2-ethoxyethoxy)ethoxy]propoxy]phenyl]-1,12:2,3:5,4:6,7:9,8:10,11-hexa[1]propene[1]yl[3]ylidene-3,4,7,8,11,12-hexahydrocoronene
14,17,20,23,26,29-ヘキサキス[4-[2-[2-(2-エトキシエトキシ)エトキシメチル]-3-[2-(2-エトキシエトキシ)エトキシ]プロポキシ]フェニル]-1,12:2,3:5,4:6,7:9,8:10,11-ヘキサ[1]プロペン[1]イル[3]イリデン-3,4,7,8,11,12-ヘキサヒドロコロネン
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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:
C174 H234 O42
Molecular formula furigana:
C174-H234-O42
Molecular weight:
2997.744
InChI:
InChI=1S/C174H234O42/c1-13-175-49-61-187-73-85-199-109-127(110-200-86-74-188-62-50-176-14-2)121-211-145-37-25-133(26-38-145)139-97-151-153-99-140(134-27-39-146(40-28-134)212-122-128(111-201-87-75-189-63-51-177-15-3)112-202-88-76-190-64-52-178-16-4)101-155-157-103-142(136-31-43-148(44-32-136)214-124-130(115-205-91-79-193-67-55-181-19-7)116-206-92-80-194-68-56-182-20-8)105-159-161-107-144(138-35-47-150(48-36-138)216-126-132(119-209-95-83-197-71-59-185-23-11)120-210-96-84-198-72-60-186-24-12)108-162-160-106-143(137-33-45-149(46-34-137)215-125-131(117-207-93-81-195-69-57-183-21-9)118-208-94-82-196-70-58-184-22-10)104-158-156-102-141(100-154-152(98-139)163(151)169-170(164(153)155)172(166(157)159)174(168(161)162)173(167(158)160)171(169)165(154)156)135-29-41-147(42-30-135)213-123-129(113-203-89-77-191-65-53-179-17-5)114-204-90-78-192-66-54-180-18-6/h25-48,97-108,127-132H,13-24,49-96,109-126H2,1-12H3
InChI key:
GCGDVIASPSRFLV-UHFFFAOYSA-N
SMILES:
CCOCCOCCOCC(COCCOCCOCC)COc1ccc(cc1)c1cc2c3cc(cc4c5cc(cc6c7cc(cc8c9cc(cc%10c%11cc(cc%12c(c1)c2c1c(c34)c(c56)c(c78)c(c9%10)c1c%11%12)c1ccc(OCC(COCCOCCOCC)COCCOCCOCC)cc1)c1ccc(OCC(COCCOCCOCC)COCCOCCOCC)cc1)c1ccc(OCC(COCCOCCOCC)COCCOCCOCC)cc1)c1ccc(OCC(COCCOCCOCC)COCCOCCOCC)cc1)c1ccc(OCC(COCCOCCOCC)COCCOCCOCC)cc1
Systematic name (3):
14,17,20,23,26,29-ヘキサキス[4-[2-[2-(2-エトキシエトキシ)エトキシメチル]-3-[2-(2-エトキシエトキシ)エトキシ]プロポキシ]フェニル]-1,12:2,3:5,4:6,7:9,8:10,11-ヘキサ[1]プロペン[1]イル[3]イリデン-3,4,7,8,11,12-ヘキサヒドロコロネン
11-({4-[11,20,25,34,39-ペンタキス(4-{3-[2-(2-エトキシエトキシ)エトキシ]-2-{[2-(2-エトキシエトキシ)エトキシ]メチル}プロポキシ}フェニル)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-イル]フェノキシ}メチル)-3,6,9,13,16,19-ヘキサオキサヘンイコサン
11-({4-[11,20,25,34,39-pentakis(4-{3-[2-(2-ethoxyethoxy)ethoxy]-2-{[2-(2-ethoxyethoxy)ethoxy]methyl}propoxy}phenyl)tridecacyclo[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-henicosaen-6-yl]phenoxy}methyl)-3,6,9,13,16,19-hexaoxahenicosane
Other name (1):
14,17,20,23,26,29-Hexakis[4-[2-[2-(2-ethoxyethoxy)ethoxymethyl]-3-[2-(2-ethoxyethoxy)ethoxy]propoxy]phenyl]-1,12:2,3:5,4:6,7:9,8:10,11-hexa[1]propene[1]yl[3]ylidene-3,4,7,8,11,12-hexahydrocoronene
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