| SpectraBase Compound ID | 2vtzCwfCFRt |
|---|---|
| InChI | InChI=1S/C32H43ClO14/c1-10-11-21(38)44-20-12-19(41-15(4)34)30(8)25(31(20,9)47-18(7)37)28(43-17(6)36)32(40)14(3)29(39)46-26(32)22(33)13(2)23-24(45-23)27(30)42-16(5)35/h14,19-20,22-28,40H,2,10-12H2,1,3-9H3/t14-,19-,20+,22-,23+,24+,25+,26-,27-,28-,30-,31+,32-/m0/s1 |
| InChIKey | HFMJFWLSIYQXIC-VPWKJMAUSA-N |
| Mol Weight | 687.1 g/mol |
| Molecular Formula | C32H43ClO14 |
| Exact Mass | 686.234134 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 68yCY35KCBz |
|---|---|
| Name | BRIAREIN-G |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H43ClO14 |
| InChI | InChI=1S/C32H43ClO14/c1-10-11-21(38)44-20-12-19(41-15(4)34)30(8)25(31(20,9)47-18(7)37)28(43-17(6)36)32(40)14(3)29(39)46-26(32)22(33)13(2)23-24(45-23)27(30)42-16(5)35/h14,19-20,22-28,40H,2,10-12H2,1,3-9H3/t14-,19-,20+,22-,23+,24+,25+,26-,27-,28-,30-,31+,32-/m0/s1 |
| InChIKey | HFMJFWLSIYQXIC-VPWKJMAUSA-N |
| Literature Reference Author | A.D.RODRIGUEZ,C.RAMIREZ,O.M.COBAR |
| Literature Reference Citation | J.NAT.PROD.,59,15(1996) |
| Literature Reference DOI | 10.1021/np960001y |
| Molecular Weight | 687.138 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP873 |