| SpectraBase Compound ID | 3KgNhkPtkb7 |
|---|---|
| InChI | InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-10-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-11-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30+,31+,32+,33-,34+,35-,36+/m0/s1 |
| InChIKey | GXZZLWVQYXFTJE-IMEDPYHGSA-N |
| Mol Weight | 622.9 g/mol |
| Molecular Formula | C37H66O7 |
| Exact Mass | 622.480854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82dVGiQkAy8 |
|---|---|
| Name | SQUAMOTACIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O7 |
| InChI | InChI=1S/C37H66O7/c1-3-4-5-6-7-8-9-10-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-11-13-16-19-30(38)27-29-26-28(2)42-37(29)41/h26,28,30-36,38-40H,3-25,27H2,1-2H3/t28-,30+,31+,32+,33-,34+,35-,36+/m0/s1 |
| InChIKey | GXZZLWVQYXFTJE-IMEDPYHGSA-N |
| Literature Reference Author | D.C.HOPP,L.ZENG,Z.GU,J.L.MCLAUGHLIN |
| Literature Reference Citation | J.NAT.PROD.,59,97(1996) |
| Literature Reference DOI | 10.1021/np960124i |
| Molecular Weight | 622.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP2535 |