John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1iaqTdsCAJU

(accessed ).

#3;3-BETA-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYLOXY]-21-BETA-[(2,3,4-TRI-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYLOXY]-22-BETA,29-DIXYDROXYOLEAN-12-ENE

Compound with spectra: 1 NMR

#3;3-BETA-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYLOXY]-21-BETA-[(2,3,4-TRI-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYLOXY]-22-BETA,29-DIXYDROXYOLEAN-12-ENE
SpectraBase Compound ID 1iaqTdsCAJU
InChI InChI=1S/C53H82O21/c1-23-37(68-24(2)55)40(69-25(3)56)41(70-26(4)57)47(67-23)74-43-42(63)50(8)18-19-52(10)27(28(50)20-49(43,7)22-54)12-13-31-51(9)16-15-32(48(5,6)30(51)14-17-53(31,52)11)71-46-39(35(61)34(60)38(72-46)44(64)65)73-45-36(62)33(59)29(58)21-66-45/h12,23,28-43,45-47,54,58-63H,13-22H2,1-11H3,(H,64,65)/t23-,28-,29+,30-,31+,32-,33-,34-,35-,36+,37-,38-,39+,40+,41+,42+,43-,45-,46+,47-,49+,50+,51-,52+,53+/m0/s1
InChIKey BZNBBHGCKGDDFZ-CEGCZRQNSA-N
Mol Weight 1055.2 g/mol
Molecular Formula C53H82O21
Exact Mass 1054.53486 g/mol
Enantiomer InChIKey BZNBBHGCKGDDFZ-UUECFYIISA-N

View Spectrum of #3;3-BETA-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYLOXY]-21-BETA-[(2,3,4-TRI-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYLOXY]-22-BETA,29-DIXYDROXYOLEAN-12-ENE

13C NMR Spectrum
Copyright Copyright © 2016-2023 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
13',16':18',21'-dietheno-1,1''-diethyl-3',14',20',31'-tetramethyldispiro[piperidine-4,17'-[5,12,22,29]tetraoxa[37,40,41]triazatetracyclo[31.13.1.0.(4,45).0(30,35)]heptatetraconta-1',3',13',15',18',20',30',34',35',45'-decaene-47',4''-piperidine]-38',42'-dione
{(4a,5,6,7,7a-.eta.)-4-(2",2"-Dimethyl-1",3"-dioxolan-4"-yl)-3a,5,8,8a-tetrahydro-2,2-dimethyl-4H-indeno[5,6-d]-1,3-dioxol-5-yl}-{(4',5',6',7',7a'-.eta.)-5'-(chloromercurio)-4'-(2"',2"'-dimethyl-1'",3'"-dioxolan-4"'-yl}-3a',5',8',8a'-tetrahydro-2',2'-dimethyl-4H-indeno5,6-d]-1',3'-dioxol-5'-yl}- iron (II)
Quamoclin II peracetate[(S)-Convolvulinoic acid 11-O.beta,-D-glucopyranosyl-(1-3)-O-[4-O-2(S)-methylbutyryl-.alpha.,L-rhamnopyranosyl-(1-4)]-O-(2-O-n-dodececanoyl).alpha.,L-rhamnopyranosyl-(1-4)-O-.alpha.-L-rhymnopyranosyl[-(1-2)-.beta.D-fucopyranoside peracetate]
41,42,43,44,45,46,47,48-Octamethoxy-4,9,14,19,24,29,34,39-octamethylnonacyclo[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
4H-9,12:15,18-Dietheno-28,31-imino-26,23-methenopyrrolo[2,3-n][1,19,6]dioxaazacyclohentriacontine-6,21,24(5H,22H,25H)-trione, 30-ethyl-2-[(3-ethyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-8,13,14,19-tetrahydro-3,29,34-trimethyl-, (Z,Z,Z)-
Dispiro[piperidine-4,2'-[7,14,24,31]tetraoxapentacyclo[30.2.2.23,6.215,18.220,23]dotetraconta[3,5,15,17,20,22,32,34,35,37,39,41]dodecaen e-19',4''-piperidine], 1,1''-diacetyl-5',33'-dibromo-16',22',36',37',40',41'-hexamethyl-
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.)]-
[(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
.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
(2S,5S*,7S*,9S,1-S,12R,13Z,15R)-2-[(2R,5R,6S)-5-Benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-9-[(R)-1-ethyl-2-oxobutyl]-15-(4-methoxybenzyloxy)-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.3.5]pentadec-13-ene
Title Journal or Book Year
Taste-modifying triterpene glycosides from Staurogyne merguensis Phytochemistry 1996
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