| SpectraBase Compound ID | 4NCAK6GmShD |
|---|---|
| InChI | InChI=1S/C36H46O6/c1-21(2)14-15-26(18-23(5)6)20-36(17-16-22(3)4)34(40)30(28(19-29(37)38)27-12-10-9-11-13-27)33-31(35(36)41)32(39)24(7)25(8)42-33/h9-13,16,18,24-26,28,39H,1,14-15,17,19-20H2,2-8H3,(H,37,38)/t24-,25-,26?,28?,36?/m0/s1 |
| InChIKey | IEZRWOUYXURXGQ-ZHFYXXPFSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C36H46O6 |
| Exact Mass | 574.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7tH7sPKHZgk |
|---|---|
| Name | BrASILIENSOPHYLLIC-ACID-C |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2023 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H46O6 |
| InChI | InChI=1S/C36H46O6/c1-21(2)14-15-26(18-23(5)6)20-36(17-16-22(3)4)34(40)30(28(19-29(37)38)27-12-10-9-11-13-27)33-31(35(36)41)32(39)24(7)25(8)42-33/h9-13,16,18,24-26,28,39H,1,14-15,17,19-20H2,2-8H3,(H,37,38)/t24-,25-,26?,28?,36?/m0/s1 |
| InChIKey | IEZRWOUYXURXGQ-ZHFYXXPFSA-N |
| Literature Reference Author | F.COTTIGLIA,B.DHANAPAL,O.STICHER,J.HEILMANN |
| Literature Reference Citation | J.NAT.PROD.,67,537(2004) |
| Literature Reference DOI | 10.1021/np030438n |
| Molecular Weight | 574.758 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ7075 |