![6-HYDROXYPELAGONIDIN-3-O-[6-O-(ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE]](/api/spectrum/K0EbdCCPJTE/structure.png?h=300&w=458 "6-HYDROXYPELAGONIDIN-3-O-[6-O-(ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE]")
| SpectraBase Compound ID | JCaTbX3HRSP |
|---|---|
| InChI | InChI=1S/C27H30O15/c1-9-17(30)21(34)23(36)26(39-9)38-8-16-20(33)22(35)24(37)27(42-16)41-15-6-12-14(7-13(29)19(32)18(12)31)40-25(15)10-2-4-11(28)5-3-10/h2-7,9,16-17,20-24,26-27,30,33-37H,8H2,1H3,(H3-,28,29,31,32)/p+1/t9-,16+,17-,20+,21+,22-,23+,24+,26+,27+/m0/s1 |
| InChIKey | XIDHXEBXMRVDTC-LQDBSNMASA-O |
| Mol Weight | 595.53 g/mol |
| Molecular Formula | C27H31O15 |
| Exact Mass | 595.166295 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K0EbdCCPJTE |
|---|---|
| Name | 6-HYDROXYPELAGONIDIN-3-O-[6-O-(ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE] |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H31O15 |
| InChI | InChI=1S/C27H30O15/c1-9-17(30)21(34)23(36)26(39-9)38-8-16-20(33)22(35)24(37)27(42-16)41-15-6-12-14(7-13(29)19(32)18(12)31)40-25(15)10-2-4-11(28)5-3-10/h2-7,9,16-17,20-24,26-27,30,33-37H,8H2,1H3,(H3-,28,29,31,32)/p+1/t9-,16+,17-,20+,21+,22-,23+,24+,26+,27+/m0/s1 |
| InChIKey | XIDHXEBXMRVDTC-LQDBSNMASA-O |
| Literature Reference Author | F.TATSUZAWA,N.SAITO,N.MURATA,K.SHINODA,A.SHIGIHARA,T.HONDA |
| Literature Reference Citation | PHYTOCHEM.,62,1239(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00683-0 |
| Molecular Weight | 595.534 g/mol |
| Solvent | CF3CO2D:DMSO-D6=1:9 |
| Source File Reference | UWLU29642 |