![OXYTROFLAVOSIDE_C;RHAMNOCITRIN_3-O-[(S)-3-HYDROXY-3-METHYLGLUTARYL-(1->4)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GALACTOPYRANOSIDE](/api/spectrum/6KUl2Xg5Yf8/structure.png?h=300&w=458 "OXYTROFLAVOSIDE_C;RHAMNOCITRIN_3-O-[(S)-3-HYDROXY-3-METHYLGLUTARYL-(1->4)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GALACTOPYRANOSIDE")
| SpectraBase Compound ID | 8iEWsWaNe3M |
|---|---|
| InChI | InChI=1S/C34H40O19/c1-13-23(41)25(43)26(44)32(48-13)53-31-27(45)29(51-21(40)11-34(2,46)10-20(38)39)19(12-35)50-33(31)52-30-24(42)22-17(37)8-16(47-3)9-18(22)49-28(30)14-4-6-15(36)7-5-14/h4-9,13,19,23,25-27,29,31-33,35-37,41,43-46H,10-12H2,1-3H3,(H,38,39)/t13-,19+,23-,25+,26+,27-,29-,31+,32-,33-,34?/m0/s1 |
| InChIKey | CQADSNASXBHFTJ-GRIDQMILSA-N |
| Mol Weight | 752.7 g/mol |
| Molecular Formula | C34H40O19 |
| Exact Mass | 752.216379 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6KUl2Xg5Yf8 |
|---|---|
| Name | OXYTROFLAVOSIDE_C;RHAMNOCITRIN_3-O-[(S)-3-HYDROXY-3-METHYLGLUTARYL-(1->4)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H40O19 |
| InChI | InChI=1S/C34H40O19/c1-13-23(41)25(43)26(44)32(48-13)53-31-27(45)29(51-21(40)11-34(2,46)10-20(38)39)19(12-35)50-33(31)52-30-24(42)22-17(37)8-16(47-3)9-18(22)49-28(30)14-4-6-15(36)7-5-14/h4-9,13,19,23,25-27,29,31-33,35-37,41,43-46H,10-12H2,1-3H3,(H,38,39)/t13-,19+,23-,25+,26+,27-,29-,31+,32-,33-,34?/m0/s1 |
| InChIKey | CQADSNASXBHFTJ-GRIDQMILSA-N |
| Literature Reference Author | S.S.WANG,X.J.ZHANG,S.QUE,G.Z.TU,D.WAN,W.CHENG,H.LIANG,J.XE,Q .Y.ZHANG |
| Literature Reference Citation | J.NAT.PROD.,75,1359(2012) |
| Literature Reference DOI | 10.1021/np300292f |
| Molecular Weight | 752.680 g/mol |
| Sample ID | 41307 |
| Solvent | DMSO-D6 |