Chem
J-GLOBAL ID：200907067051432654   Nikkaji number：J1.785.986B

6-O,6-O′-(Oxybisethylene)[1-O,1-O′-(1,3-phenylenebismethylene)bis(2-O,3-O,4-O-trimethyl-β-D-galactopyranose)]

6-O,6-O′-(オキシビスエチレン)[1-O,1-O′-(1,3-フェニレンビスメチレン)ビス(2-O,3-O,4-O-トリメチル-β-D-ガラクトピラノース)]
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： C30H48O13
Molecular formula furigana： C30-H48-O13
Molecular weight： 616.701
InChI： InChI=1S/C30H48O13/c1-31-23-21-17-38-12-10-37-11-13-39-18-22-24(32-2)26(34-4)28(36-6)30(43-22)41-16-20-9-7-8-19(14-20)15-40-29(42-21)27(35-5)25(23)33-3/h7-9,14,21-30H,10-13,15-18H2,1-6H3/t21-,22-,23+,24+,25+,26+,27-,28-,29-,30-/m1/s1
InChI key： WDFLHQZQYYBTCB-NQXIBGIKSA-N
SMILES： CO[C@H]1[C@H]2COCCOCCOC[C@H]3O[C@@H](OCc4cccc(CO[C@H](O2)[C@H](OC)[C@H]1OC)c4)[C@H](OC)[C@@H](OC)[C@H]3OC
Systematic name  (3)：
  • 6-O,6-O′-(オキシビスエチレン)[1-O,1-O′-(1,3-フェニレンビスメチレン)ビス(2-O,3-O,4-O-トリメチル-β-D-ガラクトピラノース)]
  • (1R,11R,12R,13S,14S,15R,25R,26S,27S,28R)-12,13,14,26,27,28-ヘキサメトキシ-2,10,17,20,23,29,30-ヘプタオキサテトラシクロ[23.3.1.14,8.111,15]ヘントリアコンタ-4,6,8(31)-トリエン
  • (1R,11R,12R,13S,14S,15R,25R,26S,27S,28R)-12,13,14,26,27,28-hexamethoxy-2,10,17,20,23,29,30-heptaoxatetracyclo[23.3.1.14,8.111,15]hentriaconta-4,6,8(31)-triene
Other name (1)：
  • 6-O,6-O′-(Oxybisethylene)[1-O,1-O′-(1,3-phenylenebismethylene)bis(2-O,3-O,4-O-trimethyl-β-D-galactopyranose)]
Thsaurus map：
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