Chem
J-GLOBAL ID：200907013047744754   Nikkaji number：J1.369.070G

1-O-Allyl-N-[(R)-3-[4-(trifluoromethyl)benzyloxy]octadecanoyl]-3-O,4-O-dibenzyl-α-D-glucosamine

1-O-アリル-N-[(R)-3-[4-(トリフルオロメチル)ベンジルオキシ]オクタデカノイル]-3-O,4-O-ジベンジル-α-D-グルコサミン
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： C49H68F3NO7
Molecular formula furigana： C49-H68-F3-N-O7
Molecular weight： 840.078
InChI： InChI=1S/C49H68F3NO7/c1-3-5-6-7-8-9-10-11-12-13-14-15-22-27-42(57-35-40-28-30-41(31-29-40)49(50,51)52)33-44(55)53-45-47(59-37-39-25-20-17-21-26-39)46(58-36-38-23-18-16-19-24-38)43(34-54)60-48(45)56-32-4-2/h4,16-21,23-26,28-31,42-43,45-48,54H,2-3,5-15,22,27,32-37H2,1H3,(H,53,55)/t42-,43-,45-,46-,47-,48+/m1/s1
InChI key： DYFWMVKMOYYSGU-SITRZGHZSA-N
SMILES： CCCCCCCCCCCCCCC[C@H](CC(=O)N[C@H]1[C@@H](OCC=C)O[C@H](CO)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)OCc1ccc(cc1)C(F)(F)F
Systematic name  (4)：
  • 1-O-アリル-N-[(R)-3-[4-(トリフルオロメチル)ベンジルオキシ]オクタデカノイル]-3-O,4-O-ジベンジル-α-D-グルコサミン
  • N-[(R)-3-[4-(トリフルオロメチル)ベンジルオキシ]オクタデカノイル]-1-O-アリル-3-O,4-O-ジベンジル-α-D-グルコサミン
  • (3R)-N-[(2S,3R,4R,5S,6R)-4,5-ビス(ベンジルオキシ)-6-(ヒドロキシメチル)-2-(プロパ-2-エン-1-イルオキシ)オキサン-3-イル]-3-{[4-(トリフルオロメチル)フェニル]メトキシ}オクタデカンアミド
  • (3R)-N-[(2S,3R,4R,5S,6R)-4,5-bis(benzyloxy)-6-(hydroxymethyl)-2-(prop-2-en-1-yloxy)oxan-3-yl]-3-{[4-(trifluoromethyl)phenyl]methoxy}octadecanamide
Other name (2)：
  • 1-O-Allyl-N-[(R)-3-[4-(trifluoromethyl)benzyloxy]octadecanoyl]-3-O,4-O-dibenzyl-α-D-glucosamine
  • N-[(R)-3-[4-(Trifluoromethyl)benzyloxy]octadecanoyl]-1-O-allyl-3-O,4-O-dibenzyl-α-D-glucosamine
Thsaurus map：
Thesaurus Map

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