Chem
J-GLOBAL ID:201007093447131470   Nikkaji number:J2.819.560E

1-O-β-D-Galactopyranosyl-N-[(2R)-1-oxo-2-hydroxytetracosyl]-15-methylphytosphingosine

1-O-β-D-ガラクトピラノシル-N-[(2R)-1-オキソ-2-ヒドロキシテトラコシル]-15-メチルフィトスフィンゴシン
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: C49H97NO10
Molecular formula furigana: C49-H97-N-O10
Molecular weight: 860.312
InChI: InChI=1S/C49H97NO10/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-29-32-36-42(53)48(58)50-40(38-59-49-47(57)46(56)45(55)43(37-51)60-49)44(54)41(52)35-31-28-25-23-22-24-27-30-34-39(3)33-5-2/h39-47,49,51-57H,4-38H2,1-3H3,(H,50,58)/t39?,40-,41+,42+,43+,44-,45-,46-,47+,49+/m0/s1
InChI key: XYCMQQSGWCTCRM-YFLPTKOQSA-N
SMILES: CCCCCCCCCCCCCCCCCCCCCC[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@H](O)CCCCCCCCCCC(C)CCC
Systematic name  (3):
  • 1-O-β-D-ガラクトピラノシル-N-[(2R)-1-オキソ-2-ヒドロキシテトラコシル]-15-メチルフィトスフィンゴシン
  • (2R)-N-[(2S,3S,4R)-3,4-ジヒドロキシ-15-メチル-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}オクタデカン-2-イル]-2-ヒドロキシテトラコサンアミド
  • (2R)-N-[(2S,3S,4R)-3,4-dihydroxy-15-methyl-1-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadecan-2-yl]-2-hydroxytetracosanamide
Other name (1):
  • 1-O-β-D-Galactopyranosyl-N-[(2R)-1-oxo-2-hydroxytetracosyl]-15-methylphytosphingosine
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