| SpectraBase Compound ID | 3Q97zNKXgCK |
|---|---|
| InChI | InChI=1S/C27H40O12/c1-6-27(4,34)9-7-8-13(2)23(32)36-12-18-20(29)21(30)22(31)26(38-18)39-25-19-14(3)17(28)10-15(19)16(11-37-25)24(33)35-5/h6,8,11,14-15,17-22,25-26,28-31,34H,1,7,9-10,12H2,2-5H3/b13-8+/t14-,15+,17-,18-,19+,20-,21+,22-,25-,26+,27+/m0/s1 |
| InChIKey | KXJAPGVKHIYNOZ-XSOZLOHZSA-N |
| Mol Weight | 556.6 g/mol |
| Molecular Formula | C27H40O12 |
| Exact Mass | 556.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4WH86FPjpto |
|---|---|
| Name | JASHEMSLOSIDE-B |
| Compound Number | 212 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O12 |
| InChI | InChI=1S/C27H40O12/c1-6-27(4,34)9-7-8-13(2)23(32)36-12-18-20(29)21(30)22(31)26(38-18)39-25-19-14(3)17(28)10-15(19)16(11-37-25)24(33)35-5/h6,8,11,14-15,17-22,25-26,28-31,34H,1,7,9-10,12H2,2-5H3/b13-8+/t14-,15+,17-,18-,19+,20-,21+,22-,25-,26+,27+/m0/s1 |
| InChIKey | KXJAPGVKHIYNOZ-XSOZLOHZSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,159(2007) |
| Literature Reference DOI | 10.1248/cpb.55.159 |
| Molecular Weight | 556.607 g/mol |
| Sample ID | 38008 |
| Solvent | CD3OD |