| SpectraBase Compound ID | 7iBfT7ezPqQ |
|---|---|
| InChI | InChI=1S/C20H28O3/c1-2-3-4-5-6-10-13-18-19(23-18)16-15-17-12-9-7-8-11-14-20(21)22-17/h3-4,6-7,9-10,15-19H,2,5,8,11-14H2,1H3/b4-3-,9-7-,10-6-,16-15+/t17-,18-,19+/m0/s1 |
| InChIKey | VZWNYWSEUACDLE-VYXNFCKLSA-N |
| Mol Weight | 316.44 g/mol |
| Molecular Formula | C20H28O3 |
| Exact Mass | 316.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 86EGHgn1XnN |
|---|---|
| Name | TOPSENTOLIDE_A1 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O3 |
| InChI | InChI=1S/C20H28O3/c1-2-3-4-5-6-10-13-18-19(23-18)16-15-17-12-9-7-8-11-14-20(21)22-17/h3-4,6-7,9-10,15-19H,2,5,8,11-14H2,1H3/b4-3-,9-7-,10-6-,16-15+/t17-,18-,19+/m0/s1 |
| InChIKey | VZWNYWSEUACDLE-VYXNFCKLSA-N |
| Literature Reference Author | X.LUO,F.LI,J.HONG,C.O.LEE,C.J.SIM,K.S.IM,J.H.JUNG |
| Literature Reference Citation | J.NAT.PROD.,69,567(2006) |
| Literature Reference DOI | 10.1021/np0503552 |
| Molecular Weight | 316.441 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ18175 |