| SpectraBase Compound ID | 3qHTDMf9ALN |
|---|---|
| InChI | InChI=1S/C33H40O21/c1-9-19(39)29(53-31-25(45)23(43)20(40)16(7-34)51-31)27(47)33(48-9)49-11-5-14(38)18-15(6-11)50-28(10-2-3-12(36)13(37)4-10)30(22(18)42)54-32-26(46)24(44)21(41)17(8-35)52-32/h2-6,9,16-17,19-21,23-27,29,31-41,43-47H,7-8H2,1H3/t9-,16+,17-,19-,20+,21-,23-,24+,25+,26-,27+,29+,31-,32+,33-/m1/s1 |
| InChIKey | ONEVIRKFYAWGBS-BDXYPKTESA-N |
| Mol Weight | 772.7 g/mol |
| Molecular Formula | C33H40O21 |
| Exact Mass | 772.206208 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 19ZKPt0wrTK |
|---|---|
| Name | DESACYL-SINOCRASSOSIDE-B4;QUERCETIN-3-O-BETA-D-GLUCOPYRANOSYL-7-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSIDE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40O21 |
| InChI | InChI=1S/C33H40O21/c1-9-19(39)29(53-31-25(45)23(43)20(40)16(7-34)51-31)27(47)33(48-9)49-11-5-14(38)18-15(6-11)50-28(10-2-3-12(36)13(37)4-10)30(22(18)42)54-32-26(46)24(44)21(41)17(8-35)52-32/h2-6,9,16-17,19-21,23-27,29,31-41,43-47H,7-8H2,1H3/t9-,16+,17-,19-,20+,21-,23-,24+,25+,26-,27+,29+,31-,32+,33-/m1/s1 |
| InChIKey | ONEVIRKFYAWGBS-BDXYPKTESA-N |
| Literature Reference Author | T.MORIKAWA,H.XIE,T.WANG,H.MATSUDA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,1438(2008) |
| Literature Reference DOI | 10.1248/cpb.56.1438 |
| Molecular Weight | 772.668 g/mol |
| Sample ID | 2279 |
| Solvent | DMSO-D6 |