Chem
J-GLOBAL ID：200907030114221062   Nikkaji number：J2.533.180J

Oreacerebroside D

オレアセレブロシドD
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： C46H85NO9
Molecular formula furigana： C46-H85-N-O9
Molecular weight： 796.184
InChI： InChI=1S/C46H85NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-40(50)45(54)47-38(37-55-46-44(53)43(52)42(51)41(36-48)56-46)39(49)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h16,22,24,26,32,34,38-44,46,48-53H,3-15,17-21,23,25,27-31,33,35-37H2,1-2H3,(H,47,54)/b22-16+,26-24+,34-32+/t38-,39+,40+,41+,42-,43-,44+,46+/m0/s1
InChI key： XESDOPMJHRNWTH-NZLKFSNESA-N
SMILES： CCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=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/CC/C=C/C=C/CCCCCCC
Systematic name  (3)：
  • [(2S,3R,4E,8E,10E)-2-[[(2R)-2-ヒドロキシ-1-オキソドコシル]アミノ]-3-ヒドロキシ-4,8,10-オクタデカトリエニル]β-D-ガラクトピラノシド
  • (2R)-2-ヒドロキシ-N-[(2S,3R,4E,8E,10E)-3-ヒドロキシ-1-{[(2R,3R,4S,5R,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-4,8,10-トリエン-2-イル]ドコサンアミド
  • (2R)-2-hydroxy-N-[(2S,3R,4E,8E,10E)-3-hydroxy-1-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8,10-trien-2-yl]docosanamide
Other name (3)：
  • [(2S,3R,4E,8E,10E)-2-[[(2R)-2-Hydroxy-1-oxodocosyl]amino]-3-hydroxy-4,8,10-octadecatrienyl]β-D-galactopyranoside
  • オレアセレブロシドD
  • Oreacerebroside D
Thsaurus map：
Thesaurus Map

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