| SpectraBase Compound ID | 23spTC91bXa |
|---|---|
| InChI | InChI=1S/C45H74O35/c1-2-3-66-38-30(65)37-17(10-52)73-45(38)80-36-16(9-51)72-43(29(64)23(36)58)78-34-14(7-49)70-41(27(62)21(34)56)76-32-12(5-47)68-39(25(60)19(32)54)74-31-11(4-46)67-40(24(59)18(31)53)75-33-13(6-48)69-42(26(61)20(33)55)77-35-15(8-50)71-44(79-37)28(63)22(35)57/h2,11-65H,1,3-10H2/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30+,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-/m1/s1 |
| InChIKey | RSICMMYALINTKZ-FPPUMMFJSA-N |
| Mol Weight | 1175.1 g/mol |
| Molecular Formula | C45H74O35 |
| Exact Mass | 1174.401064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3YmDwZdgjzP |
|---|---|
| Name | 2-(I)-O-ALLYL-CYCLOMALTOHEPTAOSE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O35 |
| InChI | InChI=1S/C45H74O35/c1-2-3-66-38-30(65)37-17(10-52)73-45(38)80-36-16(9-51)72-43(29(64)23(36)58)78-34-14(7-49)70-41(27(62)21(34)56)76-32-12(5-47)68-39(25(60)19(32)54)74-31-11(4-46)67-40(24(59)18(31)53)75-33-13(6-48)69-42(26(61)20(33)55)77-35-15(8-50)71-44(79-37)28(63)22(35)57/h2,11-65H,1,3-10H2/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30+,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-/m1/s1 |
| InChIKey | RSICMMYALINTKZ-FPPUMMFJSA-N |
| Literature Reference Author | G.WENZ,T.HOEFLER |
| Literature Reference Citation | CARBOHYDR.RES.,322,153(1999) |
| Literature Reference DOI | 10.1016/S0008-6215(99)00224-4 |
| Molecular Weight | 1175.062 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ2920 |