SpectraBase Compound ID | 8Ad0Ag5du3X |
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InChI | InChI=1S/C34H48O6/c1-18(2)19(3)29(38)30(40-23(7)36)21(5)28-26(39-22(6)35)16-32(9)27-11-10-24-20(4)25(37)12-13-33(24)17-34(27,33)15-14-31(28,32)8/h12-13,18,20-21,24,26-28,30H,3,10-11,14-17H2,1-2,4-9H3/t20-,21-,24-,26-,27-,28-,30+,31+,32-,33-,34+/m0/s1 |
InChIKey | PVMOACIZALDGDN-PGWPFQNMSA-N |
Mol Weight | 552.8 g/mol |
Molecular Formula | C34H48O6 |
Exact Mass | 552.345089 g/mol |
SpectraBase Spectrum ID | InJGq0pUNIp |
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Name | 9,10-DIEPI-26-DEOXYNEOBOUTOMELLERONE |
Compound Number | 20 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H48O6 |
InChI | InChI=1S/C34H48O6/c1-18(2)19(3)29(38)30(40-23(7)36)21(5)28-26(39-22(6)35)16-32(9)27-11-10-24-20(4)25(37)12-13-33(24)17-34(27,33)15-14-31(28,32)8/h12-13,18,20-21,24,26-28,30H,3,10-11,14-17H2,1-2,4-9H3/t20-,21-,24-,26-,27-,28-,30+,31+,32-,33-,34+/m0/s1 |
InChIKey | PVMOACIZALDGDN-PGWPFQNMSA-N |
Literature Reference Author | C.LONG,J.BECK,F.CANTAGREL,L.MARCOURT,L.VENDIER,B.DAVID,F.PLI SSON,F.DERGUINI,I.VA |
Literature Reference Citation | J.NAT.PROD.,75,34(2012) |
Literature Reference DOI | 10.1021/np200441h |
Molecular Weight | 552.752 g/mol |
Sample ID | 39730 |
Solvent | CD3CN |