| SpectraBase Compound ID | 2GqqxlPcYl9 |
|---|---|
| InChI | InChI=1S/C27H42O16/c1-12-17(29)19(31)20(32)25(41-12)43-22-18(30)16(9-39-26-23(34)27(35,10-28)11-40-26)42-24(21(22)33)38-7-6-13-4-5-14(36-2)15(8-13)37-3/h4-5,8,12,16-26,28-35H,6-7,9-11H2,1-3H3/t12-,16-,17-,18-,19+,20+,21-,22+,23?,24-,25-,26?,27?/m1/s1 |
| InChIKey | RNWIFADBGIEMAB-LCFUBQLXSA-N |
| Mol Weight | 622.6 g/mol |
| Molecular Formula | C27H42O16 |
| Exact Mass | 622.247285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JQmWdkE0tI0 |
|---|---|
| Name | RNWIFADBGIEMAB-LCFUBQLXSA-N |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O16 |
| InChI | InChI=1S/C27H42O16/c1-12-17(29)19(31)20(32)25(41-12)43-22-18(30)16(9-39-26-23(34)27(35,10-28)11-40-26)42-24(21(22)33)38-7-6-13-4-5-14(36-2)15(8-13)37-3/h4-5,8,12,16-26,28-35H,6-7,9-11H2,1-3H3/t12-,16-,17-,18-,19+,20+,21-,22+,23?,24-,25-,26?,27?/m1/s1 |
| InChIKey | RNWIFADBGIEMAB-LCFUBQLXSA-N |
| Literature Reference Author | K.ENDO,K.TAKAHASHI,T.ABE,H.HIKINO |
| Literature Reference Citation | HETEROCYCLES,19,261(1982) |
| Literature Reference DOI | 10.3987/R-1982-02-0261 |
| Molecular Weight | 622.621 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS9278 |