| SpectraBase Compound ID | 2FvnyOi2DSK |
|---|---|
| InChI | InChI=1S/C44H55N3O15/c1-25-35(50)38(53)40(62-43-39(54)37(52)36(51)33(61-43)24-57-42(56)29-12-7-4-8-13-29)44(58-25)60-30-16-14-27(15-17-30)32-22-34(49)46-19-9-21-47(41(55)28-10-5-3-6-11-28)23-31(18-20-45-32)59-26(2)48/h3-8,10-17,25,31-33,35-40,43-45,50-54H,9,18-24H2,1-2H3,(H,46,49)/t25-,31+,32-,33+,35-,36+,37-,38+,39+,40+,43-,44-/m0/s1 |
| InChIKey | HQVBKYXRRGKMLH-MFCXDJHKSA-N |
| Mol Weight | 865.9 g/mol |
| Molecular Formula | C44H55N3O15 |
| Exact Mass | 865.363318 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DrZqIV2rTf7 |
|---|---|
| Name | MEEHANINE_D;ISOMER_1 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H55N3O15 |
| InChI | InChI=1S/C44H55N3O15/c1-25-35(50)38(53)40(62-43-39(54)37(52)36(51)33(61-43)24-57-42(56)29-12-7-4-8-13-29)44(58-25)60-30-16-14-27(15-17-30)32-22-34(49)46-19-9-21-47(41(55)28-10-5-3-6-11-28)23-31(18-20-45-32)59-26(2)48/h3-8,10-17,25,31-33,35-40,43-45,50-54H,9,18-24H2,1-2H3,(H,46,49)/t25-,31+,32-,33+,35-,36+,37-,38+,39+,40+,43-,44-/m0/s1 |
| InChIKey | HQVBKYXRRGKMLH-MFCXDJHKSA-N |
| Literature Reference Author | T.MURATA,T.MIYASE,T.WARASHINA,F.YOSHIZAKI |
| Literature Reference Citation | J.NAT.PROD.,72,1049(2009) |
| Literature Reference DOI | 10.1021/np800691k |
| Molecular Weight | 865.932 g/mol |
| Sample ID | 32724 |
| Solvent | CD3OD |