| SpectraBase Compound ID | 7xHRdiKr6c8 |
|---|---|
| InChI | InChI=1S/C32H37NO13/c1-17(34)41-16-31-24(44-28(38)21-9-11-40-15-21)12-22-25(43-19(3)36)32(31,46-29(22,4)5)30(6,39)13-23(42-18(2)35)26(31)45-27(37)20-8-7-10-33-14-20/h7-11,14-15,22-26,39H,12-13,16H2,1-6H3/t22-,23+,24+,25-,26+,30+,31-,32+/m1/s1 |
| InChIKey | XGUMDOGBYBYOIT-SKFBFMKNSA-N |
| Mol Weight | 643.6 g/mol |
| Molecular Formula | C32H37NO13 |
| Exact Mass | 643.22649 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ExLI3Y51upM |
|---|---|
| Name | 1-ALPHA-NICOTINOYLOXY-2-ALPHA-ACETOXY-6-BETA-ACETOXY-9-BETA-FUROYLOXY-11-ACETOXY-4-BETA-HYDROXYDIHYDRO-BETA-AGAROFURAN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H37NO13 |
| InChI | InChI=1S/C32H37NO13/c1-17(34)41-16-31-24(44-28(38)21-9-11-40-15-21)12-22-25(43-19(3)36)32(31,46-29(22,4)5)30(6,39)13-23(42-18(2)35)26(31)45-27(37)20-8-7-10-33-14-20/h7-11,14-15,22-26,39H,12-13,16H2,1-6H3/t22-,23+,24+,25-,26+,30+,31-,32+/m1/s1 |
| InChIKey | XGUMDOGBYBYOIT-SKFBFMKNSA-N |
| Literature Reference Author | J.K.LIU,Z.J.JIA,D.G.WU,J.ZHOU,Q.G.WANG |
| Literature Reference Citation | PHYTOCHEM.,29,2503(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85175-F |
| Molecular Weight | 643.645 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ21088 |