SpectraBase Compound ID | 6XT6mpaA8QZ |
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InChI | InChI=1S/C34H46O8/c1-16(14-35)17(2)26(39)27(41-21(6)37)19(4)24-23(40-20(5)36)13-32(8)30-29-28(42-29)25-18(3)22(38)9-10-33(25)15-34(30,33)12-11-31(24,32)7/h9-10,16,18-19,23-25,27-30,35H,2,11-15H2,1,3-8H3/t16-,18+,19-,23-,24-,25+,27+,28-,29-,30-,31+,32-,33+,34-/m0/s1 |
InChIKey | AXTVNDHMIGPHIQ-JGCPAILOSA-N |
Mol Weight | 582.7 g/mol |
Molecular Formula | C34H46O8 |
Exact Mass | 582.319268 g/mol |
SpectraBase Spectrum ID | 3x0a5XLTbqp |
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Name | 6-BETA,7-BETA-OXIDONEOBOUTOMELLERONE |
Compound Number | 10 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H46O8 |
InChI | InChI=1S/C34H46O8/c1-16(14-35)17(2)26(39)27(41-21(6)37)19(4)24-23(40-20(5)36)13-32(8)30-29-28(42-29)25-18(3)22(38)9-10-33(25)15-34(30,33)12-11-31(24,32)7/h9-10,16,18-19,23-25,27-30,35H,2,11-15H2,1,3-8H3/t16-,18+,19-,23-,24-,25+,27+,28-,29-,30-,31+,32-,33+,34-/m0/s1 |
InChIKey | AXTVNDHMIGPHIQ-JGCPAILOSA-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 | 582.734 g/mol |
Sample ID | 39722 |
Solvent | CD3CN |