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#1;CLEMATIBETOSIDE-A;3-O-(2-O-CAFFEOYL)-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-RIBOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-AL
SpectraBase Compound ID Aqs0PrjXB9K
InChI InChI=1S/C85H130O43/c1-32-49(94)55(100)61(106)73(115-32)124-66-41(26-87)118-71(63(108)58(66)103)113-29-43-53(98)56(101)62(107)75(121-43)128-79(111)85-21-19-80(3,4)24-36(85)35-11-13-46-81(5)17-16-47(82(6,31-89)45(81)15-18-84(46,8)83(35,7)20-22-85)122-77-69(51(96)39(92)28-112-77)127-76-65(110)68(50(95)33(2)116-76)126-72-60(105)54(99)44(30-114-72)120-74-64(109)59(104)67(42(27-88)119-74)125-78-70(57(102)52(97)40(25-86)117-78)123-48(93)14-10-34-9-12-37(90)38(91)23-34/h9-12,14,23,32-33,36,39-47,49-78,86-92,94-110H,13,15-22,24-31H2,1-8H3/b14-10+/t32-,33+,36+,39+,40+,41-,42-,43-,44-,45-,46-,47+,49-,50+,51+,52+,53-,54-,55+,56+,57-,58-,59-,60-,61+,62-,63-,64-,65-,66-,67-,68-,69-,70+,71-,72+,73-,74+,75+,76+,77+,78-,81+,82+,83-,84-,85+/m1/s1
InChIKey IYJZBLFQBZWZBG-WNRCCLQQSA-N
Mol Weight 1839.9 g/mol
Molecular Formula C85H130O43
Exact Mass 1838.798583 g/mol
Enantiomer InChIKey IYJZBLFQBZWZBG-VXQYGNJWSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Studies on the Constituents of Clematis Species. VIII. Triterpenoid Saponins from the Aerial Part of Clematis tibetana Kuntz. Chemical and Pharmaceutical Bulletin 2001

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