SCABEROSIDE-HI;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID-28-O-XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->3)
Compound with spectra: 1 NMR
![SCABEROSIDE-HI;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID-28-O-XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->3)](/api/compound/Kcng5O2EvzD.png?ph=true&h=300&w=458 "SCABEROSIDE-HI;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID-28-O-XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->3)")
| SpectraBase Compound ID | Kcng5O2EvzD |
|---|---|
| InChI | InChI=1S/C75H120O39/c1-26-39(82)43(86)49(92)64(103-26)109-55-33(80)25-102-67(59(55)113-66-52(95)56(53(27(2)104-66)107-61-47(90)40(83)30(77)22-99-61)110-63-51(94)54(32(79)24-101-63)108-62-48(91)41(84)31(78)23-100-62)114-69(97)75-18-17-70(3,4)19-29(75)28-11-12-36-72(7)15-14-38(71(5,6)35(72)13-16-73(36,8)74(28,9)20-37(75)81)106-68-58(46(89)45(88)57(111-68)60(96)98-10)112-65-50(93)44(87)42(85)34(21-76)105-65/h11,26-27,29-59,61-68,76-95H,12-25H2,1-10H3/t26-,27-,29?,30+,31+,32+,33+,34+,35?,36?,37+,38-,39-,40-,41-,42-,43+,44-,45-,46-,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,58+,59+,61-,62-,63-,64-,65-,66-,67-,68+,72-,73+,74+,75+/m0/s1 |
| InChIKey | FGEOAOZNQMBEDD-GOWTVKDMSA-N |
| Mol Weight | 1645.7 g/mol |
| Molecular Formula | C75H120O39 |
| Exact Mass | 1644.740674 g/mol |
| Enantiomer InChIKey | FGEOAOZNQMBEDD-NXZGGPDUSA-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
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
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
[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
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-
Spiro[12,15:17,20-dietheno-6H,16H,22H-dibenzo[b,d][1,6,12,22]tetraox acycloheptacosin-16,4'-piperidine]-1,31-dimethanamine, 7,8,9,10,23,24,25,26-octahydro-N,N,N',N',1',13,19,32,35-nonamethyl-, (S)-
(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
1-(1-(1'-(2",3",6",8"-tetramethyl-4",5"-di(2"-methoxycarbonylethyl)-7"-ethenylporphinyl)ethoxy)ethyl)-3-(1-(1'-(2",4",5",8"-tetramethyl-3"-(1"-hydroxyethyl)-6",7"-di(2"-methoxycarbonylethyl)porphinyl)ethoxy)ethyl)-2,4,5,8-tetramethyl-6,7-di*2-methoxycarbonylethyl)porphine
(1R,5R,7S,8S,9S,10R)-1-[(2R*,5S)-5-[(2R,5R,6S)-5-benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-2-methoxy-5-methyltetrahydrofuran-2-yl]-9-ethyl-8,10-isopropylidenedioxy-1-(4-methoxybenzyloxy)-5,7-dimethyldodeca-2-yn-4-one
| Title | Journal or Book | Year |
|---|---|---|
| Advances in structural elucidation of glucuronide oleanane-type triterpene carboxylic acid 3,28-O-bisdesmosides (1962–1997) | Phytochemistry | 1999 |