Chem
J-GLOBAL ID：200907025585164820   Nikkaji number：J2.098.865G

(2S,3S,4R)-1-(β-D-Glucopyranosyloxy)-2-(tetracosanoylamino)hexadecane-3,4-diol

(2S,3S,4R)-1-(β-D-グルコピラノシルオキシ)-2-(テトラコサノイルアミノ)ヘキサデカン-3,4-ジオール
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： C46H91NO9
Molecular formula furigana： C46-H91-N-O9
Molecular weight： 802.232
InChI： InChI=1S/C46H91NO9/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-25-27-29-31-33-35-41(50)47-38(37-55-46-45(54)44(53)43(52)40(36-48)56-46)42(51)39(49)34-32-30-28-26-14-12-10-8-6-4-2/h38-40,42-46,48-49,51-54H,3-37H2,1-2H3,(H,47,50)/t38-,39+,40+,42-,43+,44-,45+,46+/m0/s1
InChI key： VTJSVLNFQKAVEP-NGGHUBGLSA-N
SMILES： CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCC
Systematic name  (3)：
  • (2S,3S,4R)-1-(β-D-グルコピラノシルオキシ)-2-(テトラコサノイルアミノ)ヘキサデカン-3,4-ジオール
  • N-[(2S,3S,4R)-3,4-ジヒドロキシ-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}ヘキサデカン-2-イル]テトラコサンアミド
  • N-[(2S,3S,4R)-3,4-dihydroxy-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecan-2-yl]tetracosanamide
Other name (1)：
  • (2S,3S,4R)-1-(β-D-Glucopyranosyloxy)-2-(tetracosanoylamino)hexadecane-3,4-diol
Thsaurus map：
Thesaurus Map

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