| SpectraBase Compound ID | 2uBlMKxz8Zr |
|---|---|
| InChI | InChI=1S/C45H63N7O9/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-38(54)51(7)39-33(6)61-45(60)34(26-27-37(46)53)49-40(55)31(4)47-42(57)36-24-23-28-52(36)44(59)35(29-30(2)3)50-41(56)32(5)48-43(39)58/h8-22,25,30-36,39H,23-24,26-29H2,1-7H3,(H2,46,53)(H,47,57)(H,48,58)(H,49,55)(H,50,56)/b9-8+,11-10+,13-12+,15-14+,17-16+,19-18+,21-20+,25-22+/t31-,32-,33-,34-,35-,36-,39-/m1/s1 |
| InChIKey | AVZDSYLYOJKQEK-IDXDSQLKSA-N |
| Mol Weight | 846.0 g/mol |
| Molecular Formula | C45H63N7O9 |
| Exact Mass | 845.468727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KlsyVzV0d5s |
|---|---|
| Name | MYXOCHROMIDE_A_3 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H63N7O9 |
| InChI | InChI=1S/C45H63N7O9/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-38(54)51(7)39-33(6)61-45(60)34(26-27-37(46)53)49-40(55)31(4)47-42(57)36-24-23-28-52(36)44(59)35(29-30(2)3)50-41(56)32(5)48-43(39)58/h8-22,25,30-36,39H,23-24,26-29H2,1-7H3,(H2,46,53)(H,47,57)(H,48,58)(H,49,55)(H,50,56)/b9-8+,11-10+,13-12+,15-14+,17-16+,19-18+,21-20+,25-22+/t31-,32-,33-,34-,35-,36-,39-/m1/s1 |
| InChIKey | AVZDSYLYOJKQEK-IDXDSQLKSA-N |
| Literature Reference Author | B.OHLENDORF,S.KEHRAUS,G.M.KOENIG |
| Literature Reference Citation | J.NAT.PROD.,71,1708(2008) |
| Literature Reference DOI | 10.1021/np800319v |
| Molecular Weight | 846.037 g/mol |
| Sample ID | 29144 |
| Solvent | ACETONE-D6 |