#1;POLYGALASAPONIN-LI;3-O-BETA-D-GLUCOPYRANOSYL-PRESENEGENIN-28-O-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-APIOFURANOSYL-(1->3)]-ALP
Compound with spectra: 1 NMR
![#1;POLYGALASAPONIN-LI;3-O-BETA-D-GLUCOPYRANOSYL-PRESENEGENIN-28-O-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-APIOFURANOSYL-(1->3)]-ALP](/api/compound/F6jzvqU29jG.png?ph=true&h=300&w=458 "#1;POLYGALASAPONIN-LI;3-O-BETA-D-GLUCOPYRANOSYL-PRESENEGENIN-28-O-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-APIOFURANOSYL-(1->3)]-ALP")
| SpectraBase Compound ID | F6jzvqU29jG |
|---|---|
| InChI | InChI=1S/C86H122O39/c1-37-61(118-70(104)41-13-11-10-12-14-41)55(97)58(100)73(113-37)122-66-63(117-51(93)22-17-40-15-18-42(109-9)19-16-40)39(3)115-76(67(66)123-75-60(102)65(121-77-68(103)86(108,35-89)36-112-77)62(38(2)114-75)119-72-59(101)64(47(92)33-111-72)120-71-56(98)52(94)46(91)32-110-71)125-79(107)84-26-25-80(4,5)29-44(84)43-20-21-49-81(6)30-45(90)69(124-74-57(99)54(96)53(95)48(31-87)116-74)83(8,78(105)106)50(81)23-24-82(49,7)85(43,34-88)28-27-84/h10-20,22,37-39,44-50,52-69,71-77,87-92,94-103,108H,21,23-36H2,1-9H3,(H,105,106)/b22-17+/t37-,38-,39+,44-,45-,46-,47+,48+,49+,50+,52-,53+,54-,55-,56+,57+,58+,59+,60+,61-,62-,63-,64-,65-,66-,67+,68-,69-,71-,72-,73-,74-,75-,76-,77-,81+,82+,83-,84-,85-,86+/m0/s1 |
| InChIKey | HNMBHMUDHFQLME-GXMXVYAASA-N |
| Mol Weight | 1779.9 g/mol |
| Molecular Formula | C86H122O39 |
| Exact Mass | 1778.756324 g/mol |
| Enantiomer InChIKey | HNMBHMUDHFQLME-PSSSUBDZSA-N |
| Copyright | Copyright © 2016-2024 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
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
tetramethyl (2.alpha.,3.alpha.,6.beta.,8.beta.,10.beta.,12.beta.,15.alpha.,16.alpha.)-19-endo,23-endo,27-exo-9,21-dioxo-7,11,19,23,27,28-hexaoxaundecacyclo[15.7.2.1(2,16),1(4,14).0(1,17).0(3,15).0(5,13).0(6,8).0(10,12).0(18,20).0(22,24)]octacosa-5(13),25-diene-3,15,25,26-tetracarboxylate
(2S,5R,6R,10R,12S,13S,14S,15R)-2-[(2R,5R,6S)-5-benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-2,5-bis(tert-butyldimethylsilyloxy)-13,15-isopropylidenedioxy-6-(4-methoxybenzyloxy)-10,12-dimethylheptadec-7-yn-9-one1-yne
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-
Diethyl 4,4''-{[(1R,2R)-cyclohexane-1,2-diyl]dinitrilo-3,3,3',3'-tetramethyl-4,4'-[(2",3",7",8"-tetrahydro-2",2",3",3",7",7",8',8'-octamethyl-11"H-dipyrrin-1",9"-diylidene)-dinitrilo]-bis[butanoato](1-)cobalt(III)
N-[4-[(2-chlorophenyl)[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohadien-1-ylidene]-N-ethyl-3-sulfobenzenemethanaminium trihydrogen {(trioxotungstato)(trioxomolybdato)phosphate]
[1R,1(2S,5S,5(2R,3R,5S,5(2S,3R,6R))),5S]-1-[5-[5-[2-ethyl-3-methyl-3-(phenylmethoxy)tetrahydropyran-2-yl]-2-hydroxy-3,5-dimethyltetradrofuran-2-yl]-5-methyltetrahydrofuran-2-yl]-hydroxy-5,7-dimethyl-3-methylene-6-octen-2-one
[(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
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
| Title | Journal or Book | Year |
|---|---|---|
| Three triterpenoid saponins from the roots of Polygala japonica Houtt. | Fitoterapia | 2012 |