| SpectraBase Compound ID | IWKZ3D2uRV |
|---|---|
| InChI | InChI=1S/C36H56O11/c1-11-14-25(39)45-31-28(19(4)5)29-23-17-20(6)30(42)32(44-22(8)38)33(46-26(40)15-12-2)35(23,9)18-24(43-21(7)37)36(29,10)34(31)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 | VPZWHHFNDPXINY-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 | LXmJWUSAKAi |
|---|---|
| Name | GAGUNIN_I |
| Compound Number | 8 |
| 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)45-31-28(19(4)5)29-23-17-20(6)30(42)32(44-22(8)38)33(46-26(40)15-12-2)35(23,9)18-24(43-21(7)37)36(29,10)34(31)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 | VPZWHHFNDPXINY-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 | 29133 |
| Solvent | CDCl3 |