| SpectraBase Compound ID | HQ4hFMpcjv3 |
|---|---|
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-8-9-10-11-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-29(43-34)16-13-12-14-17-30-26-28(25-27(2)38)37(42)44-30/h28-36,39-41H,3-26H2,1-2H3/t28-,29+,30+,31-,32-,33-,34-,35-,36-/m0/s1 |
| InChIKey | SIKLPUJCNJTZFZ-GFDTVXPQSA-N |
| Mol Weight | 638.9 g/mol |
| Molecular Formula | C37H66O8 |
| Exact Mass | 638.475769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9gfkvzIuyme |
|---|---|
| Name | 2,4-CIS-GIGANTECINONE |
| Compound Number | 1-CIS |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O8 |
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-8-9-10-11-15-18-31(39)35-23-24-36(45-35)33(41)21-20-32(40)34-22-19-29(43-34)16-13-12-14-17-30-26-28(25-27(2)38)37(42)44-30/h28-36,39-41H,3-26H2,1-2H3/t28-,29+,30+,31-,32-,33-,34-,35-,36-/m0/s1 |
| InChIKey | SIKLPUJCNJTZFZ-GFDTVXPQSA-N |
| Literature Reference Author | F.Q.ALALI,Y.ZHANG,L.ROGERS,J.L.MCLAUGHLIN |
| Literature Reference Citation | J.NAT.PROD.,60,929(1997) |
| Literature Reference DOI | 10.1021/np970211q |
| Molecular Weight | 638.926 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMZ10887 |