| SpectraBase Compound ID | 4SqiggZCQwy |
|---|---|
| InChI | InChI=1S/C34H50O8/c1-13-26(36)18(5)32-23(10)30(39)21(8)31(42-32)17(4)15-16(3)28(37)20(7)33(40-25(12)35)24(11)34-22(9)29(38)19(6)27(14-2)41-34/h15,17-18,20,24,26,28,33,36-37H,13-14H2,1-12H3/b16-15+/t17-,18+,20+,24+,26+,28-,33+/m0/s1 |
| InChIKey | WSJMGSMXRLDNGL-NUCUVDSISA-N |
| Mol Weight | 586.8 g/mol |
| Molecular Formula | C34H50O8 |
| Exact Mass | 586.350569 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4up4p5KP2Mt |
|---|---|
| Name | ONCHITRIOL-#2A |
| CAS Registry Number | 140849-45-2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H50O8 |
| InChI | InChI=1S/C34H50O8/c1-13-26(36)18(5)32-23(10)30(39)21(8)31(42-32)17(4)15-16(3)28(37)20(7)33(40-25(12)35)24(11)34-22(9)29(38)19(6)27(14-2)41-34/h15,17-18,20,24,26,28,33,36-37H,13-14H2,1-12H3/b16-15+/t17-,18+,20+,24+,26+,28-,33+/m0/s1 |
| InChIKey | WSJMGSMXRLDNGL-NUCUVDSISA-N |
| Literature Reference Author | J.RODRIGUEZ,R.RIGUERA,C.DEBITUS |
| Literature Reference Citation | J.ORG.CHEM.,57,4624(1992) |
| Literature Reference DOI | 10.1021/jo00043a018 |
| Molecular Weight | 586.766 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS2475 |