物質
J-GLOBAL ID:201507019860703963   日化辞番号:J3.362.513H

3,3′-(2,5-ジヒドロチオフェン-3,4-ジイル)ビス[N-[[(2R,4R,5S,7R,9R,10S,12R,14R,15S,17R,19R,20S,22R,24R,25S,27R,29R,30S,32R,34R,35S,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-4,9,14,19,24,29-ヘキサキス(メトキシメチル)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカメトキシ-2,5:7,10:12,15:17,20:22,25:27,30:32,35-ヘプタエタノ-1,3,6,8,11,13,16,18,21,23,26,28,31,33-テトラデカオキサシクロペンタトリアコンタン-34-イル]メチル]-2-メチル-4H-チエノ[3,2-b]ピロール-5-カルボアミド]

3,3′-(2,5-Dihydrothiophene-3,4-diyl)bis[N-[[(2R,4R,5S,7R,9R,10S,12R,14R,15S,17R,19R,20S,22R,24R,25S,27R,29R,30S,32R,34R,35S,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-4,9,14,19,24,29-hexakis(methoxymethyl)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecamethoxy-2,5:7,10:12,15:17,20:22,25:27,30:32,35-heptaethano-1,3,6,8,11,13,16,18,21,23,26,28,31,33-tetradecaoxacyclopentatriacontane-34-yl]methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide]
物質タイプ:
物質タイプ
物質タイプは以下の3種類に大別されています。
構造情報あり:構造が明確な物質
構造不確定等:構造が不明または未定の物質
混合物等:混合物、ラセミ化合物や、相対立体配置をもつ化合物等
構造情報あり
分子式: C144H234N4O70S3
分子式フリガナ: C144-H234-N4-O70-S3
分子量: 3237.590
InChI: InChI=1S/C144H234N4O70S3/c1-61-83(85-81(220-61)43-65(147-85)129(149)145-45-67-87-101(163-15)115(177-29)131(191-67)207-89-69(47-151-3)195-135(119(181-33)103(89)165-17)211-93-73(51-155-7)199-139(123(185-37)107(93)169-21)215-97-77(55-159-11)203-143(127(189-41)111(97)173-25)217-99-79(57-161-13)201-141(125(187-39)113(99)175-27)213-95-75(53-157-9)197-137(121(183-35)109(95)171-23)209-91-71(49-153-5)193-133(205-87)117(179-31)105(91)167-19)63-59-219-60-64(63)84-62(2)221-82-44-66(148-86(82)84)130(150)146-46-68-88-102(164-16)116(178-30)132(192-68)208-90-70(48-152-4)196-136(120(182-34)104(90)166-18)212-94-74(52-156-8)200-140(124(186-38)108(94)170-22)216-98-78(56-160-12)204-144(128(190-42)112(98)174-26)218-100-80(58-162-14)202-142(126(188-40)114(100)176-28)214-96-76(54-158-10)198-138(122(184-36)110(96)172-24)210-92-72(50-154-6)194-134(206-88)118(180-32)106(92)168-20/h43-44,67-80,87-128,131-144,147-148H,45-60H2,1-42H3,(H,145,149)(H,146,150)
InChI key: XQTWQOQKMIIWRH-UHFFFAOYSA-N
SMILES: COCC1OC2OC3C(CNC(=O)c4cc5sc(C)c(C6=C(CSC6)c6c(C)sc7cc([nH]c67)C(=O)NCC6OC7OC8C(COC)OC(OC9C(COC)OC(OC%10C(COC)OC(OC%11C(COC)OC(OC%12C(COC)OC(OC%13C(COC)OC(OC6C(OC)C7OC)C(OC)C%13OC)C(OC)C%12OC)C(OC)C%11OC)C(OC)C%10OC)C(OC)C9OC)C(OC)C8OC)c5[nH]4)OC(OC4C(COC)OC(OC5C(COC)OC(OC6C(COC)OC(OC7C(COC)OC(OC8C(COC)OC(OC1C(OC)C2OC)C(OC)C8OC)C(OC)C7OC)C(OC)C6OC)C(OC)C5OC)C(OC)C4OC)C(OC)C3OC
体系名 (3件):
  • 3,3′-(2,5-ジヒドロチオフェン-3,4-ジイル)ビス[N-[[(2R,4R,5S,7R,9R,10S,12R,14R,15S,17R,19R,20S,22R,24R,25S,27R,29R,30S,32R,34R,35S,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-4,9,14,19,24,29-ヘキサキス(メトキシメチル)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカメトキシ-2,5:7,10:12,15:17,20:22,25:27,30:32,35-ヘプタエタノ-1,3,6,8,11,13,16,18,21,23,26,28,31,33-テトラデカオキサシクロペンタトリアコンタン-34-イル]メチル]-2-メチル-4H-チエノ[3,2-b]ピロール-5-カルボアミド]
  • 2-メチル-3-{4-[2-メチル-5-({[36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカメトキシ-10,15,20,25,30,35-ヘキサキス(メトキシメチル)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-テトラデカオキサオクタシクロ[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]ノナテトラコンタン-5-イル]メチル}カルバモイル)-4H-チエノ[3,2-b]ピロール-3-イル]-2,5-ジヒドロチオフェン-3-イル}-N-{[36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカメトキシ-10,15,20,25,30,35-ヘキサキス(メトキシメチル)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-テトラデカオキサオクタシクロ[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]ノナテトラコンタン-5-イル]メチル}-4H-チエノ[3,2-b]ピロール-5-カルボキサミド
  • 2-methyl-3-{4-[2-methyl-5-({[36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecamethoxy-10,15,20,25,30,35-hexakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-5-yl]methyl}carbamoyl)-4H-thieno[3,2-b]pyrrol-3-yl]-2,5-dihydrothiophen-3-yl}-N-{[36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecamethoxy-10,15,20,25,30,35-hexakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-5-yl]methyl}-4H-thieno[3,2-b]pyrrole-5-carboxamide
その他の名称 (1件):
  • 3,3′-(2,5-Dihydrothiophene-3,4-diyl)bis[N-[[(2R,4R,5S,7R,9R,10S,12R,14R,15S,17R,19R,20S,22R,24R,25S,27R,29R,30S,32R,34R,35S,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-4,9,14,19,24,29-hexakis(methoxymethyl)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecamethoxy-2,5:7,10:12,15:17,20:22,25:27,30:32,35-heptaethano-1,3,6,8,11,13,16,18,21,23,26,28,31,33-tetradecaoxacyclopentatriacontane-34-yl]methyl]-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide]
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