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BARBALINE;(1S,1-BETA,2-ALPHA,3-ALPHA,4-ALPHA,7-BETA,11-ALPHA)-1,3,11-TRIACETYLOXY-2-BENZOYLOXY-7-HYDROXY-21-METHYL-13-OXO-19,21-SECOHETISAN-18-AL
SpectraBase Compound ID JrBWQJ6DTzL
InChI InChI=1S/C34H37NO11/c1-14-12-33-20-22(40)19(14)23(43-15(2)37)26(33)34-25(21(28(33)41)35(6)27(20)34)32(5,13-36)29(44-16(3)38)24(30(34)45-17(4)39)46-31(42)18-10-8-7-9-11-18/h7-11,13,19-21,23-30,41H,1,12H2,2-6H3/t19-,20?,21+,23+,24-,25?,26?,27?,28-,29+,30+,32-,33-,34+/m0/s1
InChIKey KCCYFKIQPUNVNA-BHVNOFJYSA-N
Mol Weight 635.7 g/mol
Molecular Formula C34H37NO11
Exact Mass 635.236661 g/mol
Enantiomer InChIKey KCCYFKIQPUNVNA-BECJEMSJSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
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
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
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]
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)-
N-[4-((2-chloro-4-sulfophenyl){3-methyl-4-[(3-sulfobenzyl)amino]phenyl}methylene)-2-methyl-2,5-cyclohexadien-1-ylidene](3-sulfophenyl)methanaminium trihydrogen [(trioxotungstato)(trioxomolybdato)phosphate]
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
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
(2R,3R,4S,6E,8R,9S,10S,11R,12R,13R)-1-tert-Butyldimethylsilyloxy-2,4,6,8,10,12-hexamethyl-3-(3,4-dimethoxybenzyloxy)-9,11-isopropylidenedioxy-13-(4-methoxybenzyloxy)-12-methoxymethoxypentacec-6-en-5-one
38-(3,5-Dimethylphenyl)-7,8,19,20,28,29,35,36-octahydro-6H,10H,16H,32H,34H-59:17,21-dimethano-11,15-metheno-1,2,5-[1',3']pyrimidino-5H,27H-dibenzo[b,u][1,23,4,8,16,20]dioxatetraazacyclohexacosine-32,37,39-trione
Title Journal or Book Year
The characterization and absolute stereochemistry of barbaline, a diterpenoid alkaloid from Delphinium barbeyi Phytochemistry 1996

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