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21,23-EPOXY-7-ALPHA,21-DIHYDROXYAPOTIRUCALLA-14,24-DIEN-3-ONE;MAJOR-COMPONENT
SpectraBase Compound ID 9ZiK01n7rlk
InChI InChI=1S/C30H46O4/c1-17(2)14-18-15-19(26(33)34-18)20-8-9-21-28(20,5)12-10-22-29(6)13-11-24(31)27(3,4)23(29)16-25(32)30(21,22)7/h9,14,18-20,22-23,25-26,32-33H,8,10-13,15-16H2,1-7H3/t18-,19-,20+,22-,23+,25+,26?,28+,29-,30?/m1/s1
InChIKey LYHFQGGNISJWOG-HQIRZJJUSA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H46O4
Exact Mass 470.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxsoQySZElX
Name 21,23-EPOXY-7-ALPHA,21-DIHYDROXYAPOTIRUCALLA-14,24-DIEN-3-ONE;MAJOR-COMPONENT
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O4
InChI InChI=1S/C30H46O4/c1-17(2)14-18-15-19(26(33)34-18)20-8-9-21-28(20,5)12-10-22-29(6)13-11-24(31)27(3,4)23(29)16-25(32)30(21,22)7/h9,14,18-20,22-23,25-26,32-33H,8,10-13,15-16H2,1-7H3/t18-,19-,20+,22-,23+,25+,26?,28+,29-,30?/m1/s1
InChIKey LYHFQGGNISJWOG-HQIRZJJUSA-N
Literature Reference Author C.KAMPERDICK,T.P.LIEN,G.ADAM,T.V.SUNG
Literature Reference Citation J.NAT.PROD.,66,675(2003)
Literature Reference DOI 10.1021/np020458+
Molecular Weight 470.693 g/mol
Solvent CDCl3
Source File Reference UWSI7768