Chem
J-GLOBAL ID:200907011837521523
Nikkaji number:J1.218.390I
5-[(1S,2S,3R)-1-(Trichloroacetylamino)-2,3,4-triacetoxybutyl]-2-furancarboxylic acid methyl ester
5-[(1S,2S,3R)-1-(トリクロロアセチルアミノ)-2,3,4-トリアセトキシブチル]-2-フランカルボン酸メチル
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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:
C18 H20 Cl3 NO10
Molecular formula furigana:
C18-H20-CL3-N-O10
Molecular weight:
516.710
InChI:
InChI=1S/C18H20Cl3NO10/c1-8(23)29-7-13(30-9(2)24)15(31-10(3)25)14(22-17(27)18(19,20)21)11-5-6-12(32-11)16(26)28-4/h5-6,13-15H,7H2,1-4H3,(H,22,27)/t13-,14-,15-/m1/s1
InChI key:
BEUATOWIYXETJQ-RBSFLKMASA-N
SMILES:
COC(=O)c1ccc(o1)[C@@H](NC(=O)C(Cl)(Cl)Cl)[C@H](OC(=O)C)[C@@H](COC(=O)C)OC(=O)C
Systematic name (3):
5-[(1S,2S,3R)-1-(トリクロロアセチルアミノ)-2,3,4-トリアセトキシブチル]-2-フランカルボン酸メチル
メチル 5-[(1S,2S,3R)-2,3,4-トリス(アセチルオキシ)-1-(2,2,2-トリクロロアセトアミド)ブチル]フラン-2-カルボキシラート
methyl 5-[(1S,2S,3R)-2,3,4-tris(acetyloxy)-1-(2,2,2-trichloroacetamido)butyl]furan-2-carboxylate
Other name (1):
5-[(1S,2S,3R)-1-(Trichloroacetylamino)-2,3,4-triacetoxybutyl]-2-furancarboxylic acid methyl ester
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