Chem
J-GLOBAL ID:200907027840435313   Nikkaji number:J222.090C

3,3-Bis(hydroxymethyl)-8-(8-octapentacontenyl)-1,5-dioxacyclononane-6,9-dione

3,3-ビス(ヒドロキシメチル)-8-(8-オクタペンタコンテニル)-1,5-ジオキサシクロノナン-6,9-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: C67H128O6
Molecular formula furigana: C67-H128-O6
Molecular weight: 1029.755
InChI: InChI=1S/C67H128O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-49-50-51-52-53-54-55-56-57-58-64-59-65(70)72-62-67(60-68,61-69)63-73-66(64)71/h50-51,64,68-69H,2-49,52-63H2,1H3
InChI key: CNVMQZRRWQKURG-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CCCCCCCCC1CC(=O)OCC(CO)(CO)COC1=O
Systematic name  (3):
  • 3,3-ビス(ヒドロキシメチル)-8-(8-オクタペンタコンテニル)-1,5-ジオキサシクロノナン-6,9-ジオン
  • 3,3-ビス(ヒドロキシメチル)-7-(オクタペンタコンタ-8-エン-1-イル)-1,5-ジオキソナン-6,9-ジオン
  • 3,3-bis(hydroxymethyl)-7-(octapentacont-8-en-1-yl)-1,5-dioxonane-6,9-dione
Other name (1):
  • 3,3-Bis(hydroxymethyl)-8-(8-octapentacontenyl)-1,5-dioxacyclononane-6,9-dione
Regulation number (1):
  • (9)-2019
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