Chem
J-GLOBAL ID:200907042266751456
Nikkaji number:J1.842.457F
N-Tetradecyl-1-[2-[2-(acetylamino)-2-deoxy-3-O-β-D-galactopyranosyl-β-D-glucopyranosyloxy]ethyl]-1H-1,2,3-triazole-4-carboxamide
N-テトラデシル-1-[2-[2-(アセチルアミノ)-2-デオキシ-3-O-β-D-ガラクトピラノシル-β-D-グルコピラノシルオキシ]エチル]-1H-1,2,3-トリアゾール-4-カルボアミド
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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:
C33 H59 N5 O12
Molecular formula furigana:
C33-H59-N5-O12
Molecular weight:
717.858
InChI:
InChI=1S/C33H59N5O12/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-34-31(46)22-18-38(37-36-22)16-17-47-32-25(35-21(2)41)30(27(43)24(20-40)48-32)50-33-29(45)28(44)26(42)23(19-39)49-33/h18,23-30,32-33,39-40,42-45H,3-17,19-20H2,1-2H3,(H,34,46)(H,35,41)/t23-,24-,25-,26+,27-,28+,29-,30-,32-,33+/m1/s1
InChI key:
XFTHHAXSZSHDPO-POXYAYAISA-N
SMILES:
CCCCCCCCCCCCCCNC(=O)c1cn(CCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2NC(=O)C)nn1
Systematic name (3):
N-テトラデシル-1-[2-[2-(アセチルアミノ)-2-デオキシ-3-O-β-D-ガラクトピラノシル-β-D-グルコピラノシルオキシ]エチル]-1H-1,2,3-トリアゾール-4-カルボアミド
1-(2-{[(2R,3R,4R,5S,6R)-3-アセトアミド-5-ヒドロキシ-6-(ヒドロキシメチル)-4-{[(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}オキサン-2-イル]オキシ}エチル)-N-テトラデシル-1H-1,2,3-トリアゾール-4-カルボキサミド
1-(2-{[(2R,3R,4R,5S,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl)-N-tetradecyl-1H-1,2,3-triazole-4-carboxamide
Other name (1):
N-Tetradecyl-1-[2-[2-(acetylamino)-2-deoxy-3-O-β-D-galactopyranosyl-β-D-glucopyranosyloxy]ethyl]-1H-1,2,3-triazole-4-carboxamide
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