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BELLISSAPONIN-BS1

View entire compound with spectra: 1 NMR

BELLISSAPONIN-BS1
SpectraBase Compound ID GtxUQOHWXiE
InChI InChI=1S/C59H96O26/c1-22-33(64)36(67)40(71)49(77-22)82-45-29(62)20-76-48(43(45)74)81-44-25(4)80-50(42(73)39(44)70)83-46-38(69)35(66)24(3)79-52(46)85-53(75)59-16-15-54(5,6)17-27(59)26-11-12-31-55(7)18-28(61)47(84-51-41(72)37(68)34(65)23(2)78-51)56(8,21-60)30(55)13-14-57(31,9)58(26,10)19-32(59)63/h11,22-25,27-52,60-74H,12-21H2,1-10H3
InChIKey GFGWLAXJMCZYEJ-UHFFFAOYSA-N
Mol Weight 1221.4 g/mol
Molecular Formula C59H96O26
Exact Mass 1220.618983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1pm4PieM4a
Name BELLISSAPONIN-BS1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H96O26
InChI InChI=1S/C59H96O26/c1-22-33(64)36(67)40(71)49(77-22)82-45-29(62)20-76-48(43(45)74)81-44-25(4)80-50(42(73)39(44)70)83-46-38(69)35(66)24(3)79-52(46)85-53(75)59-16-15-54(5,6)17-27(59)26-11-12-31-55(7)18-28(61)47(84-51-41(72)37(68)34(65)23(2)78-51)56(8,21-60)30(55)13-14-57(31,9)58(26,10)19-32(59)63/h11,22-25,27-52,60-74H,12-21H2,1-10H3
InChIKey GFGWLAXJMCZYEJ-UHFFFAOYSA-N
Literature Reference Author T.SCHOEPKE,K.HILLER,V.WRAY,K.D.KOEPPEL,K.YAMASAKI,R.KASAI
Literature Reference Citation J.NAT.PROD.,57,1279(1994)
Literature Reference DOI 10.1021/np50111a016
Molecular Weight 1221.396 g/mol
Solvent CD3OD
Source File Reference UWTS2475