| SpectraBase Compound ID | AP4snhemqe3 |
|---|---|
| InChI | InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3/b14-7-/t15-,16-,17+,20+,21-,22+,23+,24-,25-,26+,27+,28-,31+,32+,33-,34+/m1/s1 |
| InChIKey | MWLKXILGJPSPKZ-OTYGTFFYSA-N |
| Mol Weight | 758.7 g/mol |
| Molecular Formula | C34H46O19 |
| Exact Mass | 758.263329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JtV2p6VdTRK |
|---|---|
| Name | (Z)-ALDOSECOLOGANIN |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46O19 |
| InChI | InChI=1S/C34H46O19/c1-5-15-17(18(29(44)46-3)12-48-31(15)52-33-27(42)25(40)23(38)20(10-36)50-33)8-7-14(9-35)22-16(6-2)32(49-13-19(22)30(45)47-4)53-34-28(43)26(41)24(39)21(11-37)51-34/h5-7,9,12-13,15-17,20-28,31-34,36-43H,1-2,8,10-11H2,3-4H3/b14-7-/t15-,16-,17+,20+,21-,22+,23+,24-,25-,26+,27+,28-,31+,32+,33-,34+/m1/s1 |
| InChIKey | MWLKXILGJPSPKZ-OTYGTFFYSA-N |
| Literature Reference Author | K.MACHIDA,H.SASAKI,T.IIJIMA,M.KIKUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,1041(2002) |
| Literature Reference DOI | 10.1248/cpb.50.1041 |
| Molecular Weight | 758.728 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS6660 |