Chem
J-GLOBAL ID：200907073772797505   Nikkaji number：J950.998D

(15E)-N-[(1S,2R,3E,7Z)-1-[(β-D-Glucopyranosyloxy)methyl]-2-hydroxy-3,7-heptadecadienyl]-15-tetracosenamide

(15E)-N-[(1S,2R,3E,7Z)-1-[(β-D-グルコピラノシルオキシ)メチル]-2-ヒドロキシ-3,7-ヘプタデカジエニル]-15-テトラコセンアミド
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： C48H89NO8
Molecular formula furigana： C48-H89-N-O8
Molecular weight： 808.239
InChI： InChI=1S/C48H89NO8/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(52)49-41(40-56-48-47(55)46(54)45(53)43(39-50)57-48)42(51)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h17-18,27,29,35,37,41-43,45-48,50-51,53-55H,3-16,19-26,28,30-34,36,38-40H2,1-2H3,(H,49,52)/b18-17+,29-27-,37-35+/t41-,42+,43+,45+,46-,47+,48+/m0/s1
InChI key： JQBPIYGQWYFXMK-SAUANURHSA-N
SMILES： CCCCCCCCC/C=C\CC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCC/C=C/CCCCCCCC
Systematic name  (3)：
  • (15E)-N-[(1S,2R,3E,7Z)-1-[(β-D-グルコピラノシルオキシ)メチル]-2-ヒドロキシ-3,7-ヘプタデカジエニル]-15-テトラコセンアミド
  • (15E)-N-[(2S,3R,4E,8Z)-3-ヒドロキシ-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}オクタデカ-4,8-ジエン-2-イル]テトラコサ-15-エンアミド
  • (15E)-N-[(2S,3R,4E,8Z)-3-hydroxy-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8-dien-2-yl]tetracos-15-enamide
Other name (1)：
  • (15E)-N-[(1S,2R,3E,7Z)-1-[(β-D-Glucopyranosyloxy)methyl]-2-hydroxy-3,7-heptadecadienyl]-15-tetracosenamide
Thsaurus map：
Thesaurus Map

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