![RHAMNOCITRIN-3-O-[[3-HYDROXY-3-METHYLGLUTAROYL-(1->6)]-[BETA-D-APIOFURANOSYL-(1->2)]]-BETA-D-GALACTOPYRANOSIDE](/api/spectrum/JVYTkFttMgb/structure.png?h=300&w=458 "RHAMNOCITRIN-3-O-[[3-HYDROXY-3-METHYLGLUTAROYL-(1->6)]-[BETA-D-APIOFURANOSYL-(1->2)]]-BETA-D-GALACTOPYRANOSIDE")
| SpectraBase Compound ID | 9AOzj4KD2ME |
|---|---|
| InChI | InChI=1S/C33H38O19/c1-32(44,9-20(37)38)10-21(39)47-11-19-23(40)25(42)28(52-31-29(43)33(45,12-34)13-48-31)30(50-19)51-27-24(41)22-17(36)7-16(46-2)8-18(22)49-26(27)14-3-5-15(35)6-4-14/h3-8,19,23,25,28-31,34-36,40,42-45H,9-13H2,1-2H3,(H,37,38)/t19-,23+,25+,28-,29+,30+,31-,32?,33-/m1/s1 |
| InChIKey | XFTBRZGXKCHGKC-XBCBFQIOSA-N |
| Mol Weight | 738.6 g/mol |
| Molecular Formula | C33H38O19 |
| Exact Mass | 738.200729 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JVYTkFttMgb |
|---|---|
| Name | RHAMNOCITRIN-3-O-[[3-HYDROXY-3-METHYLGLUTAROYL-(1->6)]-[BETA-D-APIOFURANOSYL-(1->2)]]-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H38O19 |
| InChI | InChI=1S/C33H38O19/c1-32(44,9-20(37)38)10-21(39)47-11-19-23(40)25(42)28(52-31-29(43)33(45,12-34)13-48-31)30(50-19)51-27-24(41)22-17(36)7-16(46-2)8-18(22)49-26(27)14-3-5-15(35)6-4-14/h3-8,19,23,25,28-31,34-36,40,42-45H,9-13H2,1-2H3,(H,37,38)/t19-,23+,25+,28-,29+,30+,31-,32?,33-/m1/s1 |
| InChIKey | XFTBRZGXKCHGKC-XBCBFQIOSA-N |
| Literature Reference Author | N.SEMMAR,B.FENET,K.GLUCHOFF-FIASSON,A.HASAN,M.JAY |
| Literature Reference Citation | J.NAT.PROD.,65,576(2002) |
| Literature Reference DOI | 10.1021/np010328l |
| Molecular Weight | 738.653 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI5630 |