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2-O-BETA-D-GLUCOPYRANOSYL-CUCURBITACIN-I
SpectraBase Compound ID BsN5zwOYPJu
InChI InChI=1S/C36H52O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,11-13,18-19,21-22,25-28,30,37-38,41-43,45-46H,10,14-16H2,1-8H3/b12-11+/t18?,19-,21-,22?,25-,26+,27-,28?,30-,33+,34-,35+,36+/m0/s1
InChIKey LIIOJBIJVPGVGO-FBUSQXLQSA-N
Mol Weight 676.8 g/mol
Molecular Formula C36H52O12
Exact Mass 676.345877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEmuu8vZl2t
Name 2-O-beta-D-GLUCOPYRANOSYL CUCURBITACIN I
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C36H52O12
InChI InChI=1S/C36H52O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,11-13,18-19,21-22,25-28,30,37-38,41-43,45-46H,10,14-16H2,1-8H3/b12-11+/t18?,19-,21-,22?,25-,26+,27-,28?,30-,33+,34-,35+,36+/m0/s1
InChIKey LIIOJBIJVPGVGO-FBUSQXLQSA-N
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany