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CANNABISIN_B
SpectraBase Compound ID CklCDhgEjnq
InChI InChI=1S/C34H32N2O8/c37-23-6-1-19(2-7-23)11-13-35-33(43)26-15-22-17-29(41)30(42)18-25(22)31(21-5-10-27(39)28(40)16-21)32(26)34(44)36-14-12-20-3-8-24(38)9-4-20/h1-10,15-18,31-32,37-42H,11-14H2,(H,35,43)(H,36,44)/t31-,32-/m1/s1
InChIKey XENYXHLAFMZULS-ROJLCIKYSA-N
Mol Weight 596.6 g/mol
Molecular Formula C34H32N2O8
Exact Mass 596.215866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 23a2qCbNd7R
Name CANNABISIN_B
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H32N2O8
InChI InChI=1S/C34H32N2O8/c37-23-6-1-19(2-7-23)11-13-35-33(43)26-15-22-17-29(41)30(42)18-25(22)31(21-5-10-27(39)28(40)16-21)32(26)34(44)36-14-12-20-3-8-24(38)9-4-20/h1-10,15-18,31-32,37-42H,11-14H2,(H,35,43)(H,36,44)/t31-,32-/m1/s1
InChIKey XENYXHLAFMZULS-ROJLCIKYSA-N
Literature Reference Author I.SAKAKIBARA,Y.IKEYA,K.HAYASHI,H.MITSUHASHI
Literature Reference Citation PHYTOCHEM.,31,3219(1992)
Literature Reference DOI 10.1016/0031-9422(92)83479-I
Molecular Weight 596.637 g/mol
Solvent CD3OD
Source File Reference UWMZ21554