| SpectraBase Compound ID | 3j4R62RVC7o |
|---|---|
| InChI | InChI=1S/C34H52O7/c1-9-10-13-41-30(40)20(3)15-21(35)14-19(2)22-16-27(39)34(8)29-23(36)17-25-31(4,5)26(38)11-12-32(25,6)28(29)24(37)18-33(22,34)7/h19-20,22-23,25,27,36,39H,9-18H2,1-8H3/t19-,20?,22-,23+,25+,27+,32+,33-,34+/m1/s1 |
| InChIKey | WQMDPDQGTLRSTR-GGYSHFSDSA-N |
| Mol Weight | 572.8 g/mol |
| Molecular Formula | C34H52O7 |
| Exact Mass | 572.371304 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EEmpCY522hY |
|---|---|
| Name | Butyl ganoderate A |
| Appearance | White amorphous powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H52O7 |
| InChI | InChI=1S/C34H52O7/c1-9-10-13-41-30(40)20(3)15-21(35)14-19(2)22-16-27(39)34(8)29-23(36)17-25-31(4,5)26(38)11-12-32(25,6)28(29)24(37)18-33(22,34)7/h19-20,22-23,25,27,36,39H,9-18H2,1-8H3/t19-,20?,22-,23+,25+,27+,32+,33-,34+/m1/s1 |
| InChIKey | WQMDPDQGTLRSTR-GGYSHFSDSA-N |
| Instrument Name | Hewlett-Packard 5989B |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np900578h |
| Molecular Weight | 572.783 g/mol |
| Optical Rotation | [a]D25 = +18.0 (c = 0.1, CHCl3) |
| Reported Formula | C34H52O7 |
| SMILES | O[C@@]1([C@@]2([C@](CC(C3=C2[C@](C[C@]2(C(C(CC[C@]32C)=O)(C)C)[H])(O)[H])=O)([C@](C1)([C@@](CC(CC(C(=O)OCCCC)C)=O)(C)[H])[H])C)C)[H] |
| SPLASH | splash10-00kr-0942110000-8d5a5eddfc2a6a4b9510 |
| Source of Spectrum | G4-73-175-1 |
| Wiley ID | 1846409 |