Chem
J-GLOBAL ID:200907016533295014   Nikkaji number:J730.510I

(2S,3S,4R)-1-(β-D-Glucopyranosyloxy)-2-[[(2R)-1-oxo-2-hydroxydocosyl]amino]-15-methylhexadecane-3,4-diol

(2R)-N-[(1S,2S,3R)-1-(β-D-グルコピラノシルオキシメチル)-2,3-ジヒドロキシ-14-メチルペンタデシル]-2-ヒドロキシドコサンアミド
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: C45H89NO10
Molecular formula furigana: C45-H89-N-O10
Molecular weight: 804.204
InChI: InChI=1S/C45H89NO10/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26-29-32-38(49)44(54)46-36(34-55-45-43(53)42(52)41(51)39(33-47)56-45)40(50)37(48)31-28-25-22-20-19-21-24-27-30-35(2)3/h35-43,45,47-53H,4-34H2,1-3H3,(H,46,54)/t36-,37+,38+,39+,40-,41+,42-,43+,45+/m0/s1
InChI key: WEZNHIWHEVJNDO-XKFNKPFMSA-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@H](O)CCCCCCCCCCC(C)C
Systematic name  (6):
  • (2R)-N-[(1S,2S,3R)-1-[(β-D-グルコピラノシルオキシ)メチル]-2,3-ジヒドロキシ-14-メチルペンタデシル]-2-ヒドロキシドコサンアミド
  • (2R)-N-[(1S,2S,3R)-1-(β-D-グルコピラノシルオキシメチル)-2,3-ジヒドロキシ-14-メチルペンタデシル]-2-ヒドロキシドコサンアミド
  • (2S,3S,4R)-1-(β-D-グルコピラノシルオキシ)-2-[[(2R)-1-オキソ-2-ヒドロキシドコシル]アミノ]-15-メチルヘキサデカン-3,4-ジオール
  • (R)-N-[(1S,2S,3R)-1-[(β-D-グルコピラノシルオキシ)メチル]-2,3-ジヒドロキシ-14-メチルペンタデシル]2-ヒドロキシドコサンアミド
  • (2R)-N-[(2S,3S,4R)-3,4-ジヒドロキシ-15-メチル-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]-2-ヒドロキシドコサンアミド
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Other name (4):
  • (2R)-N-[(1S,2S,3R)-1-[(β-D-Glucopyranosyloxy)methyl]-2,3-dihydroxy-14-methylpentadecyl]-2-hydroxydocosanamide
  • (2R)-N-[(1S,2S,3R)-1-(β-D-Glucopyranosyloxymethyl)-2,3-dihydroxy-14-methylpentadecyl]-2-hydroxydocosanamide
  • (2S,3S,4R)-1-(β-D-Glucopyranosyloxy)-2-[[(2R)-1-oxo-2-hydroxydocosyl]amino]-15-methylhexadecane-3,4-diol
  • (R)-N-[(1S,2S,3R)-1-[(β-D-Glucopyranosyloxy)methyl]-2,3-dihydroxy-14-methylpentadecyl]2-hydroxydocosaneamide
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