| SpectraBase Compound ID | 7HBiC0S3oaD |
|---|---|
| InChI | InChI=1S/C34H56O5/c1-9-10-19-38-29-21(20-25(39-29)28(36)31(4,5)37)22-13-17-34(8)24-11-12-26-30(2,3)27(35)15-16-32(26,6)23(24)14-18-33(22,34)7/h11,21-23,25-26,28-29,36-37H,9-10,12-20H2,1-8H3/t21-,22-,23-,25+,26-,28-,29-,32+,33-,34+/m0/s1 |
| InChIKey | RKDFOKYMJHCECU-JVANGVMNSA-N |
| Mol Weight | 544.8 g/mol |
| Molecular Formula | C34H56O5 |
| Exact Mass | 544.412775 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E1wnNCnDsGY |
|---|---|
| Name | Senegalene A |
| Appearance | White amorphous powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H56O5 |
| InChI | InChI=1S/C34H56O5/c1-9-10-19-38-29-21(20-25(39-29)28(36)31(4,5)37)22-13-17-34(8)24-11-12-26-30(2,3)27(35)15-16-32(26,6)23(24)14-18-33(22,34)7/h11,21-23,25-26,28-29,36-37H,9-10,12-20H2,1-8H3/t21-,22-,23-,25+,26-,28-,29-,32+,33-,34+/m0/s1 |
| InChIKey | RKDFOKYMJHCECU-JVANGVMNSA-N |
| Instrument Name | Finnigan MAT 95 |
| Ionization Type | EI positive ion |
| Literature Reference DOI | 10.1021/np1000158 |
| Molecular Weight | 544.817 g/mol |
| Optical Rotation | [a]D20 = 0 (c = 0.100, CHCl3) |
| Reported Formula | C34H56O5 |
| SMILES | O[C@](C(C)(C)O)([C@@]1(O[C@@]([C@]([C@]2([C@@]3(CC[C@@]4([C@]5(CCC(C([C@@]5(CC=C4[C@]3(CC2)C)[H])(C)C)=O)C)[H])C)[H])(C1)[H])(OCCCC)[H])[H])[H] |
| SPLASH | splash10-0cdi-3736900000-2f039e56056c8545060c |
| Source of Spectrum | G4-73-SM34-8 |
| Wiley ID | 1848945 |