| SpectraBase Compound ID | 56xl8FTPEGW |
|---|---|
| InChI | InChI=1S/C30H34O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-7,11,17,19,23-32,37-41H,8-10H2,1H3,(H,34,35)/t11-,17?,19+,23-,24+,25+,26-,27+,28+,29-,30+/m1/s1 |
| InChIKey | YCOQCRMFNLZUCL-KBRGWEIBSA-N |
| Mol Weight | 666.6 g/mol |
| Molecular Formula | C30H34O17 |
| Exact Mass | 666.1796 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A6vguVjjcK6 |
|---|---|
| Name | NARINGIN-6''-O-MALONATE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H34O17 |
| InChI | InChI=1S/C30H34O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-7,11,17,19,23-32,37-41H,8-10H2,1H3,(H,34,35)/t11-,17?,19+,23-,24+,25+,26-,27+,28+,29-,30+/m1/s1 |
| InChIKey | YCOQCRMFNLZUCL-KBRGWEIBSA-N |
| Literature Reference Author | S.RIVA,B.DANIELI,M.LUISETTI |
| Literature Reference Citation | J.NAT.PROD.,59,618(1996) |
| Literature Reference DOI | 10.1021/np960239m |
| Molecular Weight | 666.590 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRK888 |