Chem
J-GLOBAL ID：200907089281947916   Nikkaji number：J950.997F

N-[(1S,2R,3E)-1-[(β-D-Glucopyranosyloxy)methyl]-2-hydroxy-13-methyl-3-pentadecenyl]docosanamide

N-[(1S,2R,3E)-1-[(β-D-グルコピラノシルオキシ)メチル]-2-ヒドロキシ-13-メチル-3-ペンタデセニル]ドコサンアミド
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： C45H87NO8
Molecular formula furigana： C45-H87-N-O8
Molecular weight： 770.190
InChI： InChI=1S/C45H87NO8/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-31-34-41(49)46-38(36-53-45-44(52)43(51)42(50)40(35-47)54-45)39(48)33-30-27-24-22-21-23-26-29-32-37(3)5-2/h30,33,37-40,42-45,47-48,50-52H,4-29,31-32,34-36H2,1-3H3,(H,46,49)/b33-30+/t37?,38-,39+,40+,42+,43-,44+,45+/m0/s1
InChI key： ISHCELWYNXDHHK-MLADXCSWSA-N
SMILES： CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCC(C)CC
Systematic name  (3)：
  • N-[(1S,2R,3E)-1-[(β-D-グルコピラノシルオキシ)メチル]-2-ヒドロキシ-13-メチル-3-ペンタデセニル]ドコサンアミド
  • N-[(2S,3R,4E)-3-ヒドロキシ-14-メチル-1-{[(2R,3R,4S,5S,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}ヘキサデカ-4-エン-2-イル]ドコサンアミド
  • N-[(2S,3R,4E)-3-hydroxy-14-methyl-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadec-4-en-2-yl]docosanamide
Other name (1)：
  • N-[(1S,2R,3E)-1-[(β-D-Glucopyranosyloxy)methyl]-2-hydroxy-13-methyl-3-pentadecenyl]docosanamide
Thsaurus map：
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