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QUILLAIC-ACID-3-O-[BETA-D-XYLOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDURONIC-ACID]
SpectraBase Compound ID JYMIhJnGjPj
InChI InChI=1S/C47H72O20/c1-42(2)13-14-47(41(60)61)21(15-42)20-7-8-25-43(3)11-10-27(44(4,19-49)24(43)9-12-45(25,5)46(20,6)16-26(47)51)64-40-36(67-39-32(56)30(54)29(53)23(17-48)63-39)34(33(57)35(66-40)37(58)59)65-38-31(55)28(52)22(50)18-62-38/h7,19,21-36,38-40,48,50-57H,8-18H2,1-6H3,(H,58,59)(H,60,61)/t21?,22-,23+,24?,25?,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36-,38+,39-,40-,43-,44-,45+,46+,47+/m0/s1
InChIKey KUOJCJXXMJCHIN-NRIULJBHSA-N
Mol Weight 957.1 g/mol
Molecular Formula C47H72O20
Exact Mass 956.461695 g/mol
Enantiomer InChIKey KUOJCJXXMJCHIN-SUXADHHBSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
  • 3-O-BETA-[GALACTOPYRANOSYL-(1->2)-[XYLOPYRANOSYL-(1->3)]-GLUCURONOPYRANOSYL]-QUILLAIC-ACID
[(3aS,6R,7aR)-Hexahydro-8,8-dimethyl-1-{[(2'R,3S)'-(4"-methoxy-2',3',6'-trimethylphenylsulfonyl)-2'-methylspiro[3H-indle-3,3'-pyrrolidin]-2'-yl}carbonyl-3H,3a,6-methano-2,1-benzisothiazole 2,2-dioxide
(2S,5S,7S,9S,10S,12R,13Z,15R)-9-[(1S,2R*)-1-Ethyl-2-hydroxybutyl]-2-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyltetrahydropyran-2-yl]-15-(4-methoxybenzyloxy)-2,10,12-trimethyl-1,6,8-trioxodispiro[4.1.5.3]pentadec-13-ene
41,42,43,44,45,46,47,48-Octamethoxynonacyclo[35.3.1.1(2,6).1(7,11).1(12,16).1(17,21).1(22,26).1(27,31).1(32,36)]octatetraconta-1(41),2,4,6(48),7,9,11(47),12,14,16(46),17,19,21(45),22,24,26(44),27,29,31(43),32,34,36(42),37,39-tetracosaene
26-O-.beta.-D-glucopyranosyl-22-O-methyl-furost-5-ene-3.beta.,22,26-triol 3-O-.alpha.-L-rhamnopyranosyl-(1-2)-.beta.-D-glucopyranoside peracetate
.alpha.-isomer of 1-(1-(1'-(2",3",6",8"-tetramethyl-4",5"-di(2"-methoxycarbonylethyl)-7"-acetylporphinyl)ethoxy)ethyl)-3-(1-(1'-(2",4",5",8"-tetramethyl-3"-acetyl-6",7"-di(2"-methoxycarbonylethyl)porphinyl)ethoxy)ethyl)-2,4,5,8-tetramethyl6,7-di(2-methoxycarbonylethyl)porphine
Dilithium 6-Amino-2-{m-[3,20-dioxopregn-4-en-11.alpha.-yloxy-carbonyl)propylaminoethylsulphonyl]phenyl}-1,3-dioxobenzo-[de]isoquinoline-5,8-disulphonate
4H,6H,15H,17H-Tetrapyrano[2,3-f:2',3'-f':2'',3''-h:2''',3'''-h']cyclo buta[1,2-c:4,3-c']bis[1]benzopyran-4,17-dione, 10,10a,10b,11,20c,20d-hexahydro-2,6,6,10,10,11,11,15,15,19-decamethyl-, [10aS-(10a.alpha.,10b.beta.,20c.beta.,20d.alpha.)]-
1(2H)-Pyridinyloxy, 4-[[(5.alpha.,6.alpha.)-7,8-didehydro-4,5-epoxy-6-hydroxy-3-[(1,2,3,6-tetrahydro-2,2,6,6-tetramethyl-1-oxy-4-pyridinyl)methoxy]morphinan-17-yl]methyl]-3,6-dihydro-2,2,6,6-tetramethyl-
15,11-Metheno-11H-tribenzo[c,g,n][1,6]dioxacyclopentadecin-7-carboxaldehyde, 22-ethoxy-19-(2-ethoxy-3-formyl-5-methylphenyl)-5,21-dihydro-9,13,17-trimethyl-, stereoisomer
Hexamethyl 7,9,30-trichloro-3,6,37,38-trimethoxy-1,13-diazapentacyclo[11.11.11.1(5,9).1(17,21),1(28,32)]octatriaconta-3,5,7,9(38),10,15,17,19,21(37),22,26,28,30,32(36),33-pentadecaene-3,11,15,23,26,34-hexacarboxylate
Title Journal or Book Year
Advances in structural elucidation of glucuronide oleanane-type triterpene carboxylic acid 3,28-O-bisdesmosides (1962–1997) Phytochemistry 1999
Triterpenoid saponins from Quillaja saponaria Phytochemistry 1998
Unknown Identification

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