| SpectraBase Compound ID | 6wcXr900lhf |
|---|---|
| InChI | InChI=1S/C58H106N2O18/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-35-44(64)55(72)59-42(43(63)34-31-28-25-23-20-21-24-27-30-33-41(2)3)39-75-56-53(71)52(70)51(69)47(77-56)40-76-58(57(73)74)36-45(65)49(60-48(67)38-62)54(78-58)50(68)46(66)37-61/h11-12,31,34,41-47,49-54,56,61-66,68-71H,4-10,13-30,32-33,35-40H2,1-3H3,(H,59,72)(H,60,67)(H,73,74)/b12-11-,34-31+/t42-,43+,44+,45-,46+,47+,49+,50+,51+,52-,53+,54+,56+,58+/m0/s1 |
| InChIKey | PMXHEZJFXPZXFQ-NFCSQFSNSA-N |
| Mol Weight | 1119.5 g/mol |
| Molecular Formula | C58H106N2O18 |
| Exact Mass | 1118.744065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FXVxADZ8sCR |
|---|---|
| Name | SCG-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H106N2O18 |
| InChI | InChI=1S/C58H106N2O18/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-35-44(64)55(72)59-42(43(63)34-31-28-25-23-20-21-24-27-30-33-41(2)3)39-75-56-53(71)52(70)51(69)47(77-56)40-76-58(57(73)74)36-45(65)49(60-48(67)38-62)54(78-58)50(68)46(66)37-61/h11-12,31,34,41-47,49-54,56,61-66,68-71H,4-10,13-30,32-33,35-40H2,1-3H3,(H,59,72)(H,60,67)(H,73,74)/b12-11-,34-31+/t42-,43+,44+,45-,46+,47+,49+,50+,51+,52-,53+,54+,56+,58+/m0/s1 |
| InChIKey | PMXHEZJFXPZXFQ-NFCSQFSNSA-N |
| Literature Reference Author | K.YAMADA,A.HAMADA,F.KISA,T.MIYAMOTO,R.HIGUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,46(2003) |
| Literature Reference DOI | 10.1248/cpb.51.46 |
| Molecular Weight | 1119.482 g/mol |
| Solvent | C5D5N:D2O=49:1 |
| Source File Reference | UWMS21030 |