| SpectraBase Compound ID | C2lNHShPdBk |
|---|---|
| InChI | InChI=1S/C40H75NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,26,28,32-38,40,42-47H,3-18,21-25,27,29-31H2,1-2H3,(H,41,48)/b20-19-,28-26+/t32?,33?,34?,35-,36-,37+,38-,40-/m0/s1 |
| InChIKey | HOMYIYLRRDTKAA-KIPHDIKYSA-N |
| Mol Weight | 714.0 g/mol |
| Molecular Formula | C40H75NO9 |
| Exact Mass | 713.544183 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B0SNZua6Y9I |
|---|---|
| Name | 1-O-BETA-D-GLUCOPYRANOSYL-(2S,3R,4E,8Z)-2-N-(2'-HYDROXYPALMITOYL)-OCTADECASPHINGA-4,8-DIENINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H75NO9 |
| InChI | InChI=1S/C40H75NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,26,28,32-38,40,42-47H,3-18,21-25,27,29-31H2,1-2H3,(H,41,48)/b20-19-,28-26+/t32?,33?,34?,35-,36-,37+,38-,40-/m0/s1 |
| InChIKey | HOMYIYLRRDTKAA-KIPHDIKYSA-N |
| Literature Reference Author | S.Y.KIM,Y.-H.CHOI,H.HUH,J.KIM,Y.C.KIM,H.S.LEE |
| Literature Reference Citation | J.NAT.PROD.,60,274(1997) |
| Literature Reference DOI | 10.1021/np960670b |
| Molecular Weight | 714.037 g/mol |
| Solvent | CDCl3:CD3OD=2:1 |
| Source File Reference | UWKP70 |