| SpectraBase Compound ID | 46QyOPfDmW2 |
|---|---|
| InChI | InChI=1S/C30H36O6/c1-14-6-11-30-20(14)23-19(8-10-27(30,5)36-30)28(25(32)35-23)12-17-13-29(28)21(15(17)2)22-18(7-9-26(29,4)33)16(3)24(31)34-22/h6,17-20,22-23,33H,3,7-13H2,1-2,4-5H3/t17-,18-,19?,20+,22-,23-,26-,27-,28+,29+,30+/m0/s1 |
| InChIKey | AJSGVZRKBLZUOW-CNQGCYHLSA-N |
| Mol Weight | 492.6 g/mol |
| Molecular Formula | C30H36O6 |
| Exact Mass | 492.251189 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AEAvBUlOOJS |
|---|---|
| Name | Artemyriantholide B |
| Appearance | gum |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H36O6 |
| InChI | InChI=1S/C30H36O6/c1-14-6-11-30-20(14)23-19(8-10-27(30,5)36-30)28(25(32)35-23)12-17-13-29(28)21(15(17)2)22-18(7-9-26(29,4)33)16(3)24(31)34-22/h6,17-20,22-23,33H,3,7-13H2,1-2,4-5H3/t17-,18-,19?,20+,22-,23-,26-,27-,28+,29+,30+/m0/s1 |
| InChIKey | AJSGVZRKBLZUOW-CNQGCYHLSA-N |
| Instrument Name | Finnigan-MAT 95 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np0103113 |
| Molecular Weight | 492.612 g/mol |
| Optical Rotation | [a]D = +51.0 (c = 0.4, CHCl3) |
| Reported Formula | C30H36O6 |
| SMILES | O[C@@]1([C@]23[C@@]4(C5CC[C@]6([C@@]7([C@@]([C@]5(OC4=O)[H])(C(=CC7)C)[H])O6)C)C[C@@](C3)(C(=C2[C@@]2([C@@](CC1)(C(C(O2)=O)=C)[H])[H])C)[H])C |
| SPLASH | splash10-01rj-0890000000-9794808c5cbb8eaf18fb |
| Source of Spectrum | G4-65-486-11 |
| Wiley ID | 1883608 |