| SpectraBase Compound ID | CNeSyuOfKAB |
|---|---|
| InChI | InChI=1S/C27H36O10/c1-13(28)35-19-8-10-25(4,5)27(32)23(37-15(3)30)22(36-14(2)29)21-17(26(19,27)6)12-18-16(9-11-34-18)20(21)24(31)33-7/h9,11,17,19-23,32H,8,10,12H2,1-7H3/t17-,19-,20+,21+,22+,23-,26-,27+/m0/s1 |
| InChIKey | LGYIHMCGHGMMHL-IMZNVZOKSA-N |
| Mol Weight | 520.6 g/mol |
| Molecular Formula | C27H36O10 |
| Exact Mass | 520.230847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5YOL9SHnncK |
|---|---|
| Name | CAESALPININ-MG |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O10 |
| InChI | InChI=1S/C27H36O10/c1-13(28)35-19-8-10-25(4,5)27(32)23(37-15(3)30)22(36-14(2)29)21-17(26(19,27)6)12-18-16(9-11-34-18)20(21)24(31)33-7/h9,11,17,19-23,32H,8,10,12H2,1-7H3/t17-,19-,20+,21+,22+,23-,26-,27+/m0/s1 |
| InChIKey | LGYIHMCGHGMMHL-IMZNVZOKSA-N |
| Literature Reference Author | S.K.KALAUNI,S.AWALE,Y.TEZUKA,A.H.BANSKOTA,T.Z.LINN,S.KADOTA |
| Literature Reference Citation | CHEM.PHARM.BULL.,53,214(2005) |
| Literature Reference DOI | 10.1248/cpb.53.214 |
| Molecular Weight | 520.577 g/mol |
| Sample ID | 54723 |
| Solvent | CDCl3 |