SpectraBase Compound ID | XX7xh33D6s |
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InChI | InChI=1S/C20H33NO2/c1-15(11-17(3)22)8-9-16(2)12-18-13-20(4,23)19-7-5-6-10-21(19)14-18/h8,12,16,19,23H,5-7,9-11,13-14H2,1-4H3/b15-8+,18-12-/t16-,19?,20+/m1/s1 |
InChIKey | PPBUINQSZLYENO-YXJNWWCISA-N |
Mol Weight | 319.5 g/mol |
Molecular Formula | C20H33NO2 |
Exact Mass | 319.251129 g/mol |
SpectraBase Spectrum ID | EDjz9fc1trY |
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Name | Homopumiliotoxin A |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H33NO2 |
InChI | InChI=1S/C20H33NO2/c1-15(11-17(3)22)8-9-16(2)12-18-13-20(4,23)19-7-5-6-10-21(19)14-18/h8,12,16,19,23H,5-7,9-11,13-14H2,1-4H3/b15-8+,18-12-/t16-,19?,20+/m1/s1 |
InChIKey | PPBUINQSZLYENO-YXJNWWCISA-N |
Molecular Weight | 319.489 g/mol |
SMILES | O[C@@]1(C2N(C\C(C1)=C/[C@@](C\C=C\(CC(=O)C)C)(C)[H])CCCC2)C |
SPLASH | splash10-053r-7940000000-11c8ec2a3d0eca43cde4 |
Source of Spectrum | X2-56-362-319 |
Wiley ID | 1604755 |