| SpectraBase Compound ID | 31X0BzbNTM |
|---|---|
| InChI | InChI=1S/C30H46O7/c1-17-27(32)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(31)35-16-18/h13,17,19-24,26-27,32-33H,5-12,14-16H2,1-4H3/t17-,19-,20+,21-,22+,23-,24-,26+,27+,28+,29-,30+/m1/s1 |
| InChIKey | YBZZSZQZDODUAA-FNFYTULRSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C30H46O7 |
| Exact Mass | 518.324354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HCNM1pQ2Ibv |
|---|---|
| Name | DIGITOXIGENIN-3-O-DIGINOSID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O7 |
| InChI | InChI=1S/C30H46O7/c1-17-27(32)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(31)35-16-18/h13,17,19-24,26-27,32-33H,5-12,14-16H2,1-4H3/t17-,19-,20+,21-,22+,23-,24-,26+,27+,28+,29-,30+/m1/s1 |
| InChIKey | YBZZSZQZDODUAA-FNFYTULRSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,26,3023(1978) |
| Literature Reference DOI | 10.1248/cpb.26.3023 |
| Molecular Weight | 518.691 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UNIW16715 |