| SpectraBase Compound ID | DE68NwyDKSG |
|---|---|
| InChI | InChI=1S/C30H39NO9/c1-12(2)25(35)40-18-10-29-21-17-9-28-8-13(3)19(20(22(28)29)37-14(4)32)24(39-16(6)34)30(28,36)26(29)31(17)11-27(21,7)23(18)38-15(5)33/h12,17-24,26,36H,3,8-11H2,1-2,4-7H3/t17-,18?,19+,20?,21+,22+,23?,24?,26-,27-,28+,29-,30-/m1/s1 |
| InChIKey | LWXKIHSFLLGYQM-SYFDFICNSA-N |
| Mol Weight | 557.6 g/mol |
| Molecular Formula | C30H39NO9 |
| Exact Mass | 557.262482 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HRSqtAksvXU |
|---|---|
| Name | Glandulosine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H39NO9 |
| InChI | InChI=1S/C30H39NO9/c1-12(2)25(35)40-18-10-29-21-17-9-28-8-13(3)19(20(22(28)29)37-14(4)32)24(39-16(6)34)30(28,36)26(29)31(17)11-27(21,7)23(18)38-15(5)33/h12,17-24,26,36H,3,8-11H2,1-2,4-7H3/t17-,18?,19+,20?,21+,22+,23?,24?,26-,27-,28+,29-,30-/m1/s1 |
| InChIKey | LWXKIHSFLLGYQM-SYFDFICNSA-N |
| Molecular Weight | 557.640 g/mol |
| SMILES | O[C@]12[C@@]34[C@@]([C@@]56[C@]2(N2[C@](C4)([C@]6([C@@](C2)(C(OC(=O)C)C(C5)OC(=O)C(C)C)C)[H])[H])[H])(C([C@@](C1OC(=O)C)(C(=C)C3)[H])OC(=O)C)[H] |
| SPLASH | splash10-0aba-9400200000-dd19c7ce9db53293e517 |
| Source of Spectrum | G4-65-498-2 |
| Wiley ID | 1639391 |