Chem
J-GLOBAL ID:200907031464625243
Nikkaji number:J1.816.475B
(2R,15Z)-N-[(1S,2S,3R)-1-(β-D-Glucopyranosyloxymethyl)-2,3-dihydroxy-14-methylpentadecyl]-2-hydroxy-15-tetracosenamide
(2R,15Z)-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-15-テトラコセンアミド
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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:
C47 H91 NO10
Molecular formula furigana:
C47-H91-N-O10
Molecular weight:
830.242
InChI:
InChI=1S/C47H91NO10/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-28-31-34-40(51)46(56)48-38(36-57-47-45(55)44(54)43(53)41(35-49)58-47)42(52)39(50)33-30-27-24-22-21-23-26-29-32-37(2)3/h11-12,37-45,47,49-55H,4-10,13-36H2,1-3H3,(H,48,56)/b12-11-/t38-,39+,40+,41+,42-,43+,44-,45+,47+/m0/s1
InChI key:
GXNCBEHXBIEPPV-GDVBYVLGSA-N
SMILES:
CCCCCCCC/C=C\CCCCCCCCCCCC[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 (3):
(2R,15Z)-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-15-テトラコセンアミド
(2R,15Z)-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-ヒドロキシテトラコサ-15-エンアミド
(2R,15Z)-N-[(2S,3S,4R)-3,4-dihydroxy-15-methyl-1-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecan-2-yl]-2-hydroxytetracos-15-enamide
Other name (1):
(2R,15Z)-N-[(1S,2S,3R)-1-(β-D-Glucopyranosyloxymethyl)-2,3-dihydroxy-14-methylpentadecyl]-2-hydroxy-15-tetracosenamide
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