SpectraBase Compound ID | 1cUuxd1WV2F |
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InChI | InChI=1S/C30H40O/c1-18(2)21-9-7-19(3)25-15-23(27(17-31)26(25)14-21)13-22-11-12-30-20(4)8-10-24(16-28(22)30)29(30,5)6/h13,15,17,19-21,24H,1,7-12,14,16H2,2-6H3/b23-13+/t19-,20-,21-,24-,30+/m1/s1 |
InChIKey | MEIMTLGZEJLCSF-ZHLJVWIKSA-N |
Mol Weight | 416.6 g/mol |
Molecular Formula | C30H40O |
Exact Mass | 416.307916 g/mol |
SpectraBase Spectrum ID | IklpeX1M5NO |
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Name | ASSUFULVENAL;(-)-REL-(10R)-3-((10R,E)-1-BETA,11-CYClOGUAI-4-EN-15-YLIDENE)-GUAIA-1,4,11-TRIEN-15-AL |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H40O |
InChI | InChI=1S/C30H40O/c1-18(2)21-9-7-19(3)25-15-23(27(17-31)26(25)14-21)13-22-11-12-30-20(4)8-10-24(16-28(22)30)29(30,5)6/h13,15,17,19-21,24H,1,7-12,14,16H2,2-6H3/b23-13+/t19-,20-,21-,24-,30+/m1/s1 |
InChIKey | MEIMTLGZEJLCSF-ZHLJVWIKSA-N |
Literature Reference Author | H.ACHENBACH,G.BENIRSCHKE,J.LANGE |
Literature Reference Citation | J.NAT.PROD.,59,93(1996) |
Literature Reference DOI | 10.1021/np9600255 |
Molecular Weight | 416.647 g/mol |
Solvent | CDCl3 |
Source File Reference | UWVP2534 |