3-O-[O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-2-BETA,3-BETA,16-ALPHA,21-BETA-TETRAHYDROXYOLEAN-12-ENE-23,28-DIOIC-ACID
Compound with spectra: 1 NMR
![3-O-[O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-2-BETA,3-BETA,16-ALPHA,21-BETA-TETRAHYDROXYOLEAN-12-ENE-23,28-DIOIC-ACID](/api/compound/tqSA66q8g.png?ph=true&h=300&w=458 "3-O-[O-BETA-D-XYLOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-2-BETA,3-BETA,16-ALPHA,21-BETA-TETRAHYDROXYOLEAN-12-ENE-23,28-DIOIC-ACID")
| SpectraBase Compound ID | tqSA66q8g |
|---|---|
| InChI | InChI=1S/C41H64O17/c1-36(2)11-18-17-7-8-22-37(3)12-19(43)31(58-33-29(50)27(48)30(21(15-42)56-33)57-32-28(49)26(47)20(44)16-55-32)40(6,34(51)52)23(37)9-10-38(22,4)39(17,5)13-25(46)41(18,35(53)54)14-24(36)45/h7,18-33,42-50H,8-16H2,1-6H3,(H,51,52)(H,53,54)/t18?,19-,20-,21+,22?,23?,24-,25+,26+,27+,28-,29+,30+,31-,32+,33-,37+,38+,39+,40-,41+/m0/s1 |
| InChIKey | KIHMNKKUGPSTPI-XKMXFHLHSA-N |
| Mol Weight | 828.9 g/mol |
| Molecular Formula | C41H64O17 |
| Exact Mass | 828.414351 g/mol |
| Enantiomer InChIKey | KIHMNKKUGPSTPI-SUWQEUQSSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | C5D5N |
2-(2'-acetoxymethyl-3'-(2",3",4"-tri(trimethylsiloxy).alpha.-L-rhamnosyloxy)-4'-(2"-phenyl-2"-trimethylsiloxyethylcarbonyloxy)-5'-(2"-methylpropylcarbonylamino)-1'-oxacycloheh-1'-yloxy)-4,4-di(trimethylsiloxycarbonyl)-8,13-ethano-15-hydroxy-16-methylene-perhydrophenanthrane
6H,13H-5,13:6,12-Dietheno-5a,12a-(methaniminomethano)-1H,5H,8H,12H-[1,2,4]triazolo[1,2-a][1,2,4]triazolo[1',2':1,2]pyridazino[4,5-d]pyridazine-18-acetic acid, 2,3,9,10-tetrahydro-.alpha.-(2-methylpropyl)-1,3,8,10,17,19-hexaoxo-2,9-diphenyl-, hexyl ester, stereoisomer
2-Propenoic acid, 3-phenyl-, 1,1a,1b,1c,2a,3,3a,4,6a,6b,7,8-dodecahydro-3a,6b-dihydroxy-1,1,5,7-tetramethyl-4-oxo-2a-[[(1-oxo-3-phenyl-2-propenyl)oxy]methyl]-8aH-cyclopropa[5',6']benz[1',2':7,8]az uleno[5,6-b]oxirene-8,8a-diyl ester, [1aR-(1a.alpha.,1b.beta.,1c.beta.,2a.beta.,3a.beta.,6a.alpha.,6b.alpha.,7.alpha.,8.beta.,8a.alpha.)]-
1,1,2',2'-Tetraethyl-1',2',3',8',9',10',11',23',34',35',36',35'a-dodecahydro-14'-20'-38'-41'-tetramethylspiro[piperidine-4,17'-[4,6:13,16:18,21]trietheno[28,32:31,35]dimethano[17H][1,6,16,21]tetraoxacyclotriacontino[25,24-c]pyridinium]Dichloride
1,6-Dioxaspiro[4.5]decane-7-hexanoic acid, 2-[5-ethyltetrahydro-5-[tetrahydro-3-methyl-5-[tetrahydro-6-(hydroxym ethyl)-3,5-dimethyl-2H-pyran-2-yl]-2-furyl]-2-furyl]-9-hydroxy-.delta.-methoxy-.epsilon.,2,8-trimethyl-, methyl ester, diacetate
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-
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
(1Z,3R)-1-[(2R*3R,5R,6S)-6-[(1R,2R)-2-Acetoxy-1-ethylbutyl]-2-methoxy-3,5-dimethyltetrahydrofuran-2-yl]-3-[(2R*,5S)-5-[(2R,5R,6S)-5-benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-2-methoxy-5-methyltetrahydrofuran-2-yl]-3-(4-methoxybenzyloxy)prop-1-ene
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
1,7,2,6-Ethanediylidene-6a,10c-(methaniminomethano)-3H,6H,7H,8H-2b,4, 5a,7a,9,10a-hexaazadicyclopent[d,i]acenaphthylene-12-acetic acid, 1-bromooctahydro-.alpha.-(2-methylpropyl)-3,5,8,10,11,13-hexaoxo-4,9- diphenyl-, hexyl ester, (S)-
| Title | Journal or Book | Year |
|---|---|---|
| Triterpenoid saponins from the ground part of Aster ageratoides var. ovatus | Phytochemistry | 1999 |