| SpectraBase Compound ID | IhQyh3pYjUa |
|---|---|
| InChI | InChI=1S/C29H34O15/c1-12-22(36)23(37)24(38)28(40-12)44-26-25(43-21(35)7-3-13-2-5-15(31)17(33)8-13)19(10-30)42-29-27(26)41-20(11-39-29)14-4-6-16(32)18(34)9-14/h2-9,12,19-20,22-34,36-38H,10-11H2,1H3/b7-3+/t12-,19+,20+,22-,23+,24+,25+,26-,27+,28-,29+/m1/s1 |
| InChIKey | FPOYEEKZOOLVJA-NHCXNJCJSA-N |
| Mol Weight | 622.6 g/mol |
| Molecular Formula | C29H34O15 |
| Exact Mass | 622.18977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B6ejvspbd7e |
|---|---|
| Name | OROBANCHOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H34O15 |
| InChI | InChI=1S/C29H34O15/c1-12-22(36)23(37)24(38)28(40-12)44-26-25(43-21(35)7-3-13-2-5-15(31)17(33)8-13)19(10-30)42-29-27(26)41-20(11-39-29)14-4-6-16(32)18(34)9-14/h2-9,12,19-20,22-34,36-38H,10-11H2,1H3/b7-3+/t12-,19+,20+,22-,23+,24+,25+,26-,27+,28-,29+/m1/s1 |
| InChIKey | FPOYEEKZOOLVJA-NHCXNJCJSA-N |
| Literature Reference Author | C.ANDARY,R.WYLDE,L.MAURY,A.HEITZ,A.DUBOURG,S.NISHIBE |
| Literature Reference Citation | PHYTOCHEM.,37,855(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90370-4 |
| Molecular Weight | 622.580 g/mol |
| Solvent | DMSO-D6:CF3CO2H |
| Source File Reference | UWLU23532 |