| SpectraBase Compound ID | 9l3LWKHlO9x |
|---|---|
| InChI | InChI=1S/C30H32O13/c1-27-13-29(37)19-11-30(27,28(19,26(42-27)43-29)14-39-24(36)16-7-9-17(31)10-8-16)41-25-22(34)21(33)20(32)18(40-25)12-38-23(35)15-5-3-2-4-6-15/h2-10,18-22,25-26,31-34,37H,11-14H2,1H3/t18-,19?,20-,21+,22-,25+,26+,27-,28+,29+,30-/m0/s1 |
| InChIKey | VIWQCBZFJFSCLC-TWSSRVPESA-N |
| Mol Weight | 600.6 g/mol |
| Molecular Formula | C30H32O13 |
| Exact Mass | 600.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H3XcNrlIsAZ |
|---|---|
| Name | BENZOYLOXYPAEONIFLORIN |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32O13 |
| InChI | InChI=1S/C30H32O13/c1-27-13-29(37)19-11-30(27,28(19,26(42-27)43-29)14-39-24(36)16-7-9-17(31)10-8-16)41-25-22(34)21(33)20(32)18(40-25)12-38-23(35)15-5-3-2-4-6-15/h2-10,18-22,25-26,31-34,37H,11-14H2,1H3/t18-,19?,20-,21+,22-,25+,26+,27-,28+,29+,30-/m0/s1 |
| InChIKey | VIWQCBZFJFSCLC-TWSSRVPESA-N |
| Literature Reference Author | H.C.LIN,H.Y.DING,T.S.WU,P.L.WU |
| Literature Reference Citation | PHYTOCHEM.,41,237(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00526-9 |
| Molecular Weight | 600.576 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU3841 |