| SpectraBase Compound ID | E69Xh0IId9W |
|---|---|
| InChI | InChI=1S/C27H39N3O3/c1-8-27(6,12-11-22(32)16(2)3)20-9-10-21-23-18(14-28-24(20)23)13-19(15-31)29-26(33)25(17(4)5)30(21)7/h8-10,14,17,19,22,25,28,31-32H,1-2,11-13,15H2,3-7H3,(H,29,33)/t19-,22?,25-,27-/m0/s1 |
| InChIKey | RLQWNZUFDRUTMZ-LERHOHMLSA-N |
| Mol Weight | 453.6 g/mol |
| Molecular Formula | C27H39N3O3 |
| Exact Mass | 453.299142 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HqySbHBKIAT |
|---|---|
| Name | Lynbyatoxin B |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H39N3O3 |
| InChI | InChI=1S/C27H39N3O3/c1-8-27(6,12-11-22(32)16(2)3)20-9-10-21-23-18(14-28-24(20)23)13-19(15-31)29-26(33)25(17(4)5)30(21)7/h8-10,14,17,19,22,25,28,31-32H,1-2,11-13,15H2,3-7H3,(H,29,33)/t19-,22?,25-,27-/m0/s1 |
| InChIKey | RLQWNZUFDRUTMZ-LERHOHMLSA-N |
| Molecular Weight | 453.627 g/mol |
| SMILES | [nH]1cc2C[C@@](CO)(NC([C@@](N(c3c2c1c(cc3)[C@@](C=C)(CCC(C(=C)C)O)C)C)(C(C)C)[H])=O)[H] |
| SPLASH | splash10-0udi-0023900000-875cde0981a92ab94d0e |
| Source of Spectrum | X2-53-1595-5 |
| Wiley ID | 1603807 |