Chem
J-GLOBAL ID:200907026541177360
Nikkaji number:J2.761.735B
(3R,9R)-3-Acetoxy-9-hydroxyicosanoic acid (1S)-1-(acetoxymethyl)-2-hydroxyethyl ester
(3R,9R)-3-アセトキシ-9-ヒドロキシイコサン酸(1S)-1-(アセトキシメチル)-2-ヒドロキシエチル
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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:
C27 H50 O8
Molecular formula furigana:
C27-H50-O8
Molecular weight:
502.689
InChI:
InChI=1S/C27H50O8/c1-4-5-6-7-8-9-10-11-13-16-24(31)17-14-12-15-18-25(34-23(3)30)19-27(32)35-26(20-28)21-33-22(2)29/h24-26,28,31H,4-21H2,1-3H3/t24-,25-,26+/m1/s1
InChI key:
FFWQYPHFHGDBSV-CYXNTTPDSA-N
SMILES:
CCCCCCCCCCC[C@@H](O)CCCCC[C@H](CC(=O)O[C@@H](CO)COC(=O)C)OC(=O)C
Systematic name (3):
(3R,9R)-3-アセトキシ-9-ヒドロキシイコサン酸(1S)-1-(アセトキシメチル)-2-ヒドロキシエチル
(2S)-1-(アセチルオキシ)-3-ヒドロキシプロパン-2-イル (3R,9R)-3-(アセチルオキシ)-9-ヒドロキシイコサノアート
(2S)-1-(acetyloxy)-3-hydroxypropan-2-yl (3R,9R)-3-(acetyloxy)-9-hydroxyicosanoate
Other name (1):
(3R,9R)-3-Acetoxy-9-hydroxyicosanoic acid (1S)-1-(acetoxymethyl)-2-hydroxyethyl ester
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