| SpectraBase Compound ID | 8xpzYVARfeK |
|---|---|
| InChI | InChI=1S/C48H78O16/c1-22-31(52)34(55)37(58)40(59-22)63-39-36(57)33(54)26(20-49)61-42(39)64-38-35(56)32(53)23(2)60-41(38)62-30-13-14-45(7)27(44(30,5)6)12-15-46(8)28(45)11-10-24-25-18-43(3,4)16-17-48(25,21-50)29(51)19-47(24,46)9/h10-11,22-23,26-42,49-58H,12-21H2,1-9H3/t22-,23+,26+,27-,28+,29+,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | IFHVGHIPUAYRLB-GZMXBYGBSA-N |
| Mol Weight | 911.1 g/mol |
| Molecular Formula | C48H78O16 |
| Exact Mass | 910.528986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CWpW2wqJUUE |
|---|---|
| Name | ROTUNDIOSIDE-E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O16 |
| InChI | InChI=1S/C48H78O16/c1-22-31(52)34(55)37(58)40(59-22)63-39-36(57)33(54)26(20-49)61-42(39)64-38-35(56)32(53)23(2)60-41(38)62-30-13-14-45(7)27(44(30,5)6)12-15-46(8)28(45)11-10-24-25-18-43(3,4)16-17-48(25,21-50)29(51)19-47(24,46)9/h10-11,22-23,26-42,49-58H,12-21H2,1-9H3/t22-,23+,26+,27-,28+,29+,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | IFHVGHIPUAYRLB-GZMXBYGBSA-N |
| Literature Reference Author | S.Q.LUO,H.F.JIN,H.KAWAI,H.SETO,N.OTAKE |
| Literature Reference Citation | AGR.BIOL.CHEM.,51,1515(1987) |
| Literature Reference DOI | 10.1271/bbb1961.51.1515 |
| Molecular Weight | 911.138 g/mol |
| Solvent | Unknown |
| Source File Reference | UWBT8144 |