| SpectraBase Compound ID | 2Nq4O5w6gJs |
|---|---|
| InChI | InChI=1S/C36H56O11/c1-11-14-25(39)45-24-18-35(9)23(17-20(6)30(42)32(43-21(7)37)33(35)44-22(8)38)29-28(19(4)5)31(46-26(40)15-12-2)34(36(24,29)10)47-27(41)16-13-3/h17,19,23-24,28-34,42H,11-16,18H2,1-10H3/t23-,24+,28-,29+,30+,31-,32+,33-,34+,35-,36+/m1/s1 |
| InChIKey | DZNCDWMYHUXBQE-QHZQYIMRSA-N |
| Mol Weight | 664.8 g/mol |
| Molecular Formula | C36H56O11 |
| Exact Mass | 664.382263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4yN03l4f6OK |
|---|---|
| Name | GAGUNIN_P |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O11 |
| InChI | InChI=1S/C36H56O11/c1-11-14-25(39)45-24-18-35(9)23(17-20(6)30(42)32(43-21(7)37)33(35)44-22(8)38)29-28(19(4)5)31(46-26(40)15-12-2)34(36(24,29)10)47-27(41)16-13-3/h17,19,23-24,28-34,42H,11-16,18H2,1-10H3/t23-,24+,28-,29+,30+,31-,32+,33-,34+,35-,36+/m1/s1 |
| InChIKey | DZNCDWMYHUXBQE-QHZQYIMRSA-N |
| Literature Reference Author | K.H.JANG,J.JEON,S.RYU,H.S.LEE,K.B.OH,J.SHIN |
| Literature Reference Citation | J.NAT.PROD.,71,1701(2008) |
| Literature Reference DOI | 10.1021/np800293y |
| Molecular Weight | 664.834 g/mol |
| Sample ID | 29140 |
| Solvent | CDCl3 |