| SpectraBase Compound ID | E88GIcA7lYp |
|---|---|
| InChI | InChI=1S/C28H45N5O7/c1-8-11-20-27(38)33-15-10-12-19(33)25(36)31-23(17(5)9-2)26(37)30-22(16(3)4)28(39)32(7)18(6)24(35)29-14-13-21(34)40-20/h8,16-20,22-23H,1,9-15H2,2-7H3,(H,29,35)(H,30,37)(H,31,36)/t17?,18-,19?,20?,22-,23-/m0/s1 |
| InChIKey | BNDTXDIWZPIRNI-CIVGNCJDSA-N |
| Mol Weight | 563.7 g/mol |
| Molecular Formula | C28H45N5O7 |
| Exact Mass | 563.331899 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4dSF4r8WkqR |
|---|---|
| Name | Desmethyl-destruxin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H45N5O7 |
| InChI | InChI=1S/C28H45N5O7/c1-8-11-20-27(38)33-15-10-12-19(33)25(36)31-23(17(5)9-2)26(37)30-22(16(3)4)28(39)32(7)18(6)24(35)29-14-13-21(34)40-20/h8,16-20,22-23H,1,9-15H2,2-7H3,(H,29,35)(H,30,37)(H,31,36)/t17?,18-,19?,20?,22-,23-/m0/s1 |
| InChIKey | BNDTXDIWZPIRNI-CIVGNCJDSA-N |
| Molecular Weight | 563.696 g/mol |
| SMILES | N1CCC(OC(C(N2C(C(N[C@](C(N[C@](C(N([C@](C1=O)(C)[H])C)=O)(C(C)C)[H])=O)(C(CC)C)[H])=O)CCC2)=O)CC=C)=O |
| SPLASH | splash10-0bt9-0000090000-6339a7a364d3991606f8 |
| Source of Spectrum | X2-56-647-6 |
| Wiley ID | 1604860 |