Chem
J-GLOBAL ID:200907006321996408
Nikkaji number:J2.691.943F
2-O,6-O-Bis(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)-L-ascorbic acid
2-O,6-O-ビス(2,2,3,3,4,4,5,5,6,6,7,7-ドデカフルオロヘプタノイル)-L-アスコルビン酸
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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:
C20 H8 F24 O8
Molecular formula furigana:
C20-H8-F24-O8
Molecular weight:
832.238
InChI:
InChI=1S/C20H8F24O8/c21-7(22)11(25,26)15(33,34)19(41,42)17(37,38)13(29,30)9(48)50-1-2(45)4-3(46)5(6(47)51-4)52-10(49)14(31,32)18(39,40)20(43,44)16(35,36)12(27,28)8(23)24/h2,4,7-8,45-46H,1H2/t2-,4+/m0/s1
InChI key:
JNVIYICMFMVTIA-ZAFYKAAXSA-N
SMILES:
O[C@@H](COC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F)[C@H]1OC(=O)C(=C1O)OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
Systematic name (3):
2-O,6-O-ビス(2,2,3,3,4,4,5,5,6,6,7,7-ドデカフルオロヘプタノイル)-L-アスコルビン酸
(2S)-2-[(2R)-4-[(2,2,3,3,4,4,5,5,6,6,7,7-ドデカフルオロヘプタノイル)オキシ]-3-ヒドロキシ-5-オキソ-2,5-ジヒドロフラン-2-イル]-2-ヒドロキシエチル 2,2,3,3,4,4,5,5,6,6,7,7-ドデカフルオロヘプタノアート
(2S)-2-[(2R)-4-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)oxy]-3-hydroxy-5-oxo-2,5-dihydrofuran-2-yl]-2-hydroxyethyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoate
Other name (1):
2-O,6-O-Bis(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoyl)-L-ascorbic acid
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