![2,3-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20,22-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20-HYDROXYECDYZONE;MIXTURE_OF_ISOMERS](/api/spectrum/6MBxH4W38LW/structure.png?h=300&w=458 "2,3-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20,22-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20-HYDROXYECDYZONE;MIXTURE_OF_ISOMERS")
| SpectraBase Compound ID | GgqXRF1o88R |
|---|---|
| InChI | InChI=1S/2C37H56O9/c2*1-21(38)18-34(7)43-27-17-25-26(40)16-24-23(32(25,5)20-28(27)44-34)10-14-33(6)29(11-15-37(24,33)42)36(9)30(12-13-31(3,4)41)45-35(8,46-36)19-22(2)39/h2*16,23,25,27-30,41-42H,10-15,17-20H2,1-9H3/t2*23-,25-,27+,28-,29-,30+,32+,33+,34-,35+,36+,37+/m00/s1 |
| InChIKey | AFUHINDVPQMNFM-QBTJDPDYSA-N |
| Mol Weight | 1289.7 g/mol |
| Molecular Formula | C74H112O18 |
| Exact Mass | 1288.784867 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6MBxH4W38LW |
|---|---|
| Name | 2,3-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20,22-O-[(2-R)-4-OXOPENTAN-2-YLIDENE]-20-HYDROXYECDYZONE;MIXTURE_OF_ISOMERS |
| Compound Number | XV |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C74H112O18 |
| InChI | InChI=1S/2C37H56O9/c2*1-21(38)18-34(7)43-27-17-25-26(40)16-24-23(32(25,5)20-28(27)44-34)10-14-33(6)29(11-15-37(24,33)42)36(9)30(12-13-31(3,4)41)45-35(8,46-36)19-22(2)39/h2*16,23,25,27-30,41-42H,10-15,17-20H2,1-9H3/t2*23-,25-,27+,28-,29-,30+,32+,33+,34-,35+,36+,37+/m00/s1 |
| InChIKey | AFUHINDVPQMNFM-QBTJDPDYSA-N |
| Literature Reference Author | I.V.GALYAUTDINOV,S.R.NAZMEEVA,R.G.SAVCHENKO,N.A.VESKINA,D.V. A.A.FATYKHOV,L.M.KHA |
| Literature Reference Citation | RUSS.J.ORG.CHEM.,40,675(2004) |
| Literature Reference DOI | 10.1023/B:RUJO.0000043713.14760.02 |
| Molecular Weight | 1289.692 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16699 |