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14-angeloyloxy-2.alpha.,3.alpha.-epoxy-1-oxo-O-methylcacalol
SpectraBase Compound ID BeWyw9HDt3k
InChI InChI=1S/C21H22O6/c1-6-9(2)21(23)26-8-12-13-10(3)7-25-19(13)18(24-5)15-14(12)11(4)17-20(27-17)16(15)22/h6-7,11,17,20H,8H2,1-5H3/b9-6-/t11-,17+,20-/m1/s1
InChIKey FBZSDKQMXBAROQ-HHTLWVCYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTrXAOka2Wg
Name 14-ANGELOYLOXY-2-ALPHA,3-ALPHA-EPOXY-1-OXO-O-METHYLCACALOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-6-9(2)21(23)26-8-12-13-10(3)7-25-19(13)18(24-5)15-14(12)11(4)17-20(27-17)16(15)22/h6-7,11,17,20H,8H2,1-5H3/b9-6-/t11-,17+,20-/m1/s1
InChIKey FBZSDKQMXBAROQ-HHTLWVCYSA-N
Literature Reference Author G.D.HUANG,Y.J.YANG,W.S.WU,Y.ZHU
Literature Reference Citation J.NAT.PROD.,73,1954(2010)
Literature Reference DOI 10.1021/np1004505
Molecular Weight 370.402 g/mol
Sample ID 37109
Solvent CDCl3