| SpectraBase Compound ID | 7drdI1QNOre |
|---|---|
| InChI | InChI=1S/C27H41NO8/c1-6-28-11-25(12-33-4)8-7-18(32)27-16-9-15-17(31)10-26(36-14(3)30,19(16)21(15)35-13(2)29)20(24(27)28)22(34-5)23(25)27/h15-24,31-32H,6-12H2,1-5H3/t15?,16?,17-,18-,19?,20?,21-,22-,23?,24?,25-,26+,27?/m0/s1 |
| InChIKey | SWPQSEPVSHKEJQ-BMVMHCQSSA-N |
| Mol Weight | 507.6 g/mol |
| Molecular Formula | C27H41NO8 |
| Exact Mass | 507.283217 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5dV7gtD0fHY |
|---|---|
| Name | Destaphisine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H41NO8 |
| InChI | InChI=1S/C27H41NO8/c1-6-28-11-25(12-33-4)8-7-18(32)27-16-9-15-17(31)10-26(36-14(3)30,19(16)21(15)35-13(2)29)20(24(27)28)22(34-5)23(25)27/h15-24,31-32H,6-12H2,1-5H3/t15?,16?,17-,18-,19?,20?,21-,22-,23?,24?,25-,26+,27?/m0/s1 |
| InChIKey | SWPQSEPVSHKEJQ-BMVMHCQSSA-N |
| Molecular Weight | 507.624 g/mol |
| SMILES | O[C@]1(C[C@]2(C3C(C45[C@](CC[C@]6(CN(C4C2[C@@](C56)(OC)[H])CC)COC)(O)[H])CC1[C@@]3(OC(=O)C)[H])OC(=O)C)[H] |
| SPLASH | splash10-052f-9000000000-864dd8326640ea39426c |
| Source of Spectrum | X2-51-576-9 |
| Wiley ID | 1602715 |