Chem
J-GLOBAL ID：201507015823717020   Nikkaji number：J3.401.240G

(E)-1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-galactopyranosyloxy)-6-[2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-2-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecyl)-8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-heptadecafluoropentadecyl]-2-hexene

(E)-1-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシルオキシ)-6-[2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)-2-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-ヘプタデカフルオロトリデシル)-8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-ヘプタデカフルオロペンタデシル]-2-ヘキセン
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： C58H55F51O10
Molecular formula furigana： C58-H55-F51-O10
Molecular weight： 1880.987
InChI： InChI=1S/C58H55F51O10/c1-25(110)115-24-29-30(116-26(2)111)31(117-27(3)112)32(118-28(4)113)33(119-29)114-23-15-7-5-6-10-16-34(21-22-37(63,64)40(69,70)43(75,76)46(81,82)49(87,88)52(93,94)55(99,100)58(107,108)109,17-11-8-13-19-35(59,60)38(65,66)41(71,72)44(77,78)47(83,84)50(89,90)53(95,96)56(101,102)103)18-12-9-14-20-36(61,62)39(67,68)42(73,74)45(79,80)48(85,86)51(91,92)54(97,98)57(104,105)106/h7,15,29-33H,5-6,8-14,16-24H2,1-4H3/b15-7+/t29-,30+,31+,32-,33-/m1/s1
InChI key： DNRVTMHRJJJKMS-GYBZYJQQSA-N
SMILES： CC(=O)OC[C@H]1O[C@@H](OC/C=C/CCCCC(CCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(CCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name  (3)：
  • (E)-1-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシルオキシ)-6-[2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)-2-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-ヘプタデカフルオロトリデシル)-8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-ヘプタデカフルオロペンタデシル]-2-ヘキセン
  • [(2R,3S,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-{[(2E)-14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,21-ヘプタデカフルオロ-8-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)-8-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-ヘプタデカフルオロトリデシル)ヘンイコサ-2-エン-1-イル]オキシ}オキサン-2-イル]メチル アセタート
  • [(2R,3S,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-{[(2E)-14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,21-heptadecafluoro-8-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-8-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecyl)henicos-2-en-1-yl]oxy}oxan-2-yl]methyl acetate
Other name (1)：
  • (E)-1-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-galactopyranosyloxy)-6-[2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-2-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecyl)-8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,15-heptadecafluoropentadecyl]-2-hexene
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