Chem
J-GLOBAL ID：200907003922213843   Nikkaji number：J2.483.472G

1-O,4-[(4-Deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)]-6-O-[3-[4-[2-[2-(β-D-galactopyranosyloxy)ethoxy]ethyl]phenoxy]propyl]-4-deoxy-α-D-glucopyranose

1-O,4-[(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)]-6-O-[3-[4-[2-[2-(β-D-ガラクトピラノシルオキシ)エトキシ]エチル]フェノキシ]プロピル]-4-デオキシ-α-D-グルコピラノース
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： C61H98O43
Molecular formula furigana： C61-H98-O43
Molecular weight： 1519.412
InChI： InChI=1S/C61H98O43/c62-12-22-30(69)31(70)39(78)54(90-22)89-11-10-86-9-6-20-2-4-21(5-3-20)88-8-1-7-87-19-29-53-38(77)46(85)61(97-29)103-52-28(18-68)95-59(44(83)36(52)75)101-50-26(16-66)93-57(42(81)34(50)73)99-48-24(14-64)91-55(40(79)32(48)71)98-47-23(13-63)92-56(41(80)33(47)72)100-49-25(15-65)94-58(43(82)35(49)74)102-51-27(17-67)96-60(104-53)45(84)37(51)76/h2-5,22-85H,1,6-19H2/t22-,23-,24-,25-,26-,27-,28-,29-,30+,31+,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45?,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m1/s1
InChI key： GBQOIKLJLLGGRM-LMIRFXEGSA-N
SMILES： OC[C@H]1O[C@@H](OCCOCCc2ccc(OCCCOC[C@H]3O[C@@H]4O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@@H]%10[C@@H](CO)O[C@H](O[C@H]3[C@H](O)[C@H]4O)C(O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)cc2)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 1-O,4-[(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)]-6-O-[3-[4-[2-[2-(β-D-ガラクトピラノシルオキシ)エトキシ]エチル]フェノキシ]プロピル]-4-デオキシ-α-D-グルコピラノース
  • (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30-ヘキサキス(ヒドロキシメチル)-35-[(3-{4-[2-(2-{[(2R,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}エトキシ)エチル]フェノキシ}プロポキシ)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-36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカオール
  • (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-35-[(3-{4-[2-(2-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethoxy)ethyl]phenoxy}propoxy)methyl]-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]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol
Other name (1)：
  • 1-O,4-[(4-Deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)]-6-O-[3-[4-[2-[2-(β-D-galactopyranosyloxy)ethoxy]ethyl]phenoxy]propyl]-4-deoxy-α-D-glucopyranose
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