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#4;TERNATIN-C4;3-O-(6-O-MALONYL-BETA-D-GLUCOPYRANOSYL)-3'-O-(6-O-[(E)-4-O-BETA-D-GLUCOPYRANOSYL-PARA-COUMARYL]-BETA-D-GLUCOPYRANOSYL)-5'-O-BETA-D-GLUCOPYRANOSY
SpectraBase Compound ID I08e9wkQsve
InChI InChI=1S/C51H58O32/c52-13-27-35(61)39(65)43(69)48(80-27)75-20-4-1-17(2-5-20)3-6-32(58)73-15-29-37(63)41(67)45(71)50(82-29)78-25-8-18(7-24(34(25)60)77-49-44(70)40(66)36(62)28(14-53)81-49)47-26(11-21-22(55)9-19(54)10-23(21)76-47)79-51-46(72)42(68)38(64)30(83-51)16-74-33(59)12-31(56)57/h1-11,27-30,35-46,48-53,61-72H,12-16H2,(H3-,54,55,56,57,60)/p+1/b6-3+/t27-,28-,29-,30+,35-,36-,37-,38+,39+,40+,41+,42-,43-,44-,45-,46+,48-,49-,50-,51+/m0/s1
InChIKey LLDMWHWRSUPHJJ-PLVQDWHYSA-O
Mol Weight 1184.0 g/mol
Molecular Formula C51H59O32
Exact Mass 1183.298945 g/mol
Enantiomer InChIKey LLDMWHWRSUPHJJ-OPULGRLRSA-O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6:CF3COOD=9:1
Title Journal or Book Year
Eight New Anthocyanins, Ternatins C1−C5 and D3 and Preternatins A3 and C4 from Young Clitoria ternatea Flowers Journal of Natural Products 1998
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