| SpectraBase Compound ID | CECHrilofTN |
|---|---|
| InChI | InChI=1S/C25H35NO6/c1-6-13(3)16-8-7-15-10-12(2)9-14(4)18(15)19(16)22(28)20-21(27)17(26-23(20)29)11-25(5,32)24(30)31/h6-8,12,14-19,28,32H,9-11H2,1-5H3,(H,26,29)(H,30,31)/b13-6+,22-20+/t12-,14+,15-,16+,17+,18-,19-,25+/m1/s1 |
| InChIKey | AVZATKWNGXCSDN-JXMUZPLUSA-N |
| Mol Weight | 445.6 g/mol |
| Molecular Formula | C25H35NO6 |
| Exact Mass | 445.246438 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J00gBjgKBIi |
|---|---|
| Name | SCH_21092 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H35NO6 |
| InChI | InChI=1S/C25H35NO6/c1-6-13(3)16-8-7-15-10-12(2)9-14(4)18(15)19(16)22(28)20-21(27)17(26-23(20)29)11-25(5,32)24(30)31/h6-8,12,14-19,28,32H,9-11H2,1-5H3,(H,26,29)(H,30,31)/b13-6+,22-20+/t12-,14+,15-,16+,17+,18-,19-,25+/m1/s1 |
| InChIKey | AVZATKWNGXCSDN-JXMUZPLUSA-N |
| Literature Reference Author | S.W.YANG,R.MIERZWA,J.TERRACCIANO,M.PATEL,V.GULLO,N.WAGNER,B. BAROUDY,M.PUAR,T.M.C |
| Literature Reference Citation | J.NAT.PROD.,69,1025(2006) |
| Literature Reference DOI | 10.1021/np060121y |
| Molecular Weight | 445.556 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ18969 |