John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=10aJtvamZT4 SpectraBase Spectrum ID=CYT3vH5CNDP

(accessed ).
MUSAMBIN-C;1-ALPHA,3-BETA-DIHYDROXY-CYCLOART-26-METHYLENE-24-OXO-28-CARBOXYLIC-ACID
SpectraBase Compound ID 10aJtvamZT4
InChI InChI=1S/C30H46O5/c1-17(2)20(31)8-7-18(3)19-11-12-27(5)21-9-10-22-28(6,25(34)35)23(32)15-24(33)30(22)16-29(21,30)14-13-26(19,27)4/h18-19,21-24,32-33H,1,7-16H2,2-6H3,(H,34,35)/t18-,19-,21+,22+,23+,24+,26-,27+,28+,29+,30-/m1/s1
InChIKey AQNNINVBKDUNJN-WNQROMOCSA-N
Mol Weight 486.7 g/mol
Molecular Formula C30H46O5
Exact Mass 486.334525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYT3vH5CNDP
Name MUSAMBIN-C;1-ALPHA,3-BETA-DIHYDROXY-CYCLOART-26-METHYLENE-24-OXO-28-CARBOXYLIC-ACID
Compound Number 3
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O5
InChI InChI=1S/C30H46O5/c1-17(2)20(31)8-7-18(3)19-11-12-27(5)21-9-10-22-28(6,25(34)35)23(32)15-24(33)30(22)16-29(21,30)14-13-26(19,27)4/h18-19,21-24,32-33H,1,7-16H2,2-6H3,(H,34,35)/t18-,19-,21+,22+,23+,24+,26-,27+,28+,29+,30-/m1/s1
InChIKey AQNNINVBKDUNJN-WNQROMOCSA-N
Literature Reference Author D.LACROIX,S.PRADO,A.DEVILLE,S.KRIEF,V.DUMONTET,J.KASENENE,E. MOURAY,C.BORIES,B.BO
Literature Reference Citation PHYTOCHEM.,70,1239(2009)
Literature Reference DOI 10.1016/j.phytochem.2009.06.020
Molecular Weight 486.692 g/mol
Sample ID 45565
Solvent CD3OD
SpectraBase Batch ID CUJLqCQV4Be