Chem
J-GLOBAL ID:200907018505384861   Nikkaji number:J1.804.002F

(4R)-4β,15β-Bis(14-hydroxytetradecyl)-7α,8β,9α,18α,19β,20α-hexakis(benzyloxy)-6α,10α:17α,21α-diepoxy-1,5,12,16-tetraoxacyclodocosane-2,13-dione

(4R)-4β,15β-ビス(14-ヒドロキシテトラデシル)-7α,8β,9α,18α,19β,20α-ヘキサキス(ベンジルオキシ)-6α,10α:17α,21α-ジエポキシ-1,5,12,16-テトラオキサシクロドコサン-2,13-ジオン
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: C88H120O16
Molecular formula furigana: C88-H120-O16
Molecular weight: 1433.912
InChI: InChI=1S/C88H120O16/c89-57-41-19-15-11-7-3-1-5-9-13-17-39-55-75-59-79(91)93-67-78-82(96-62-70-45-29-22-30-46-70)84(98-64-72-49-33-24-34-50-72)86(100-66-74-53-37-26-38-54-74)88(104-78)102-76(56-40-18-14-10-6-2-4-8-12-16-20-42-58-90)60-80(92)94-68-77-81(95-61-69-43-27-21-28-44-69)83(97-63-71-47-31-23-32-48-71)85(87(101-75)103-77)99-65-73-51-35-25-36-52-73/h21-38,43-54,75-78,81-90H,1-20,39-42,55-68H2/t75?,76?,77-,78-,81-,82-,83+,84+,85-,86-,87-,88-/m1/s1
InChI key: GUTAQHMZVLFMFZ-NSQWZZTNSA-N
SMILES: OCCCCCCCCCCCCCCC1CC(=O)OC[C@H]2O[C@@H](OC(CCCCCCCCCCCCCCO)CC(=O)OC[C@H]3O[C@@H](O1)[C@H](OCc1ccccc1)[C@@H](OCc1ccccc1)[C@@H]3OCc1ccccc1)[C@H](OCc1ccccc1)[C@@H](OCc1ccccc1)[C@@H]2OCc1ccccc1
Systematic name  (4):
  • 1-O,6-O-[[(3R)-1-オキソ-17-ヒドロキシヘプタデカン-3,1-ジイル](2-O,3-O,4-O-トリベンジル-β-D-グルコピラノース-6-O,1-O-ジイル)[(3R)-1-オキソ-17-ヒドロキシヘプタデカン-3,1-ジイル]]-2-O,3-O,4-O-トリベンジル-β-D-グルコピラノース
  • (4R)-4β,15β-ビス(14-ヒドロキシテトラデシル)-7α,8β,9α,18α,19β,20α-ヘキサキス(ベンジルオキシ)-6α,10α:17α,21α-ジエポキシ-1,5,12,16-テトラオキサシクロドコサン-2,13-ジオン
  • (1R,3R,8R,9R,10S,11R,12R,14R,19R,20R,21S,22R)-9,10,11,20,21,22-ヘキサキス(ベンジルオキシ)-3,14-ビス(14-ヒドロキシテトラデシル)-2,6,13,17,23,24-ヘキサオキサトリシクロ[17.3.1.18,12]テトラコサン-5,16-ジオン
  • (1R,3R,8R,9R,10S,11R,12R,14R,19R,20R,21S,22R)-9,10,11,20,21,22-hexakis(benzyloxy)-3,14-bis(14-hydroxytetradecyl)-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.18,12]tetracosane-5,16-dione
Other name (2):
  • 1-O,6-O-[[(3R)-1-Oxo-17-hydroxyheptadecane-3,1-diyl](2-O,3-O,4-O-tribenzyl-β-D-glucopyranose-6-O,1-O-diyl)[(3R)-1-oxo-17-hydroxyheptadecane-3,1-diyl]]-2-O,3-O,4-O-tribenzyl-β-D-glucopyranose
  • (4R)-4β,15β-Bis(14-hydroxytetradecyl)-7α,8β,9α,18α,19β,20α-hexakis(benzyloxy)-6α,10α:17α,21α-diepoxy-1,5,12,16-tetraoxacyclodocosane-2,13-dione
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