![RHAMNOCITRIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/93CVhuUZ6VG/structure.png?h=300&w=458 "RHAMNOCITRIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 5ztcGuGBN3W |
|---|---|
| InChI | InChI=1S/C28H30O15/c1-28(38,9-18(31)32)10-19(33)40-11-17-21(34)23(36)24(37)27(42-17)43-26-22(35)20-15(30)7-14(39-2)8-16(20)41-25(26)12-3-5-13(29)6-4-12/h3-8,17,21,23-24,27,29-30,34,36-38H,9-11H2,1-2H3,(H,31,32)/t17-,21-,23+,24-,27+,28+/m1/s1 |
| InChIKey | ZADGYZMBIIDGTO-MBXSJXQWSA-N |
| Mol Weight | 606.53 g/mol |
| Molecular Formula | C28H30O15 |
| Exact Mass | 606.15847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 93CVhuUZ6VG |
|---|---|
| Name | RHAMNOCITRIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H30O15 |
| InChI | InChI=1S/C28H30O15/c1-28(38,9-18(31)32)10-19(33)40-11-17-21(34)23(36)24(37)27(42-17)43-26-22(35)20-15(30)7-14(39-2)8-16(20)41-25(26)12-3-5-13(29)6-4-12/h3-8,17,21,23-24,27,29-30,34,36-38H,9-11H2,1-2H3,(H,31,32)/t17-,21-,23+,24-,27+,28+/m1/s1 |
| InChIKey | ZADGYZMBIIDGTO-MBXSJXQWSA-N |
| Literature Reference Author | S.SONG,X.ZHENG,W.LIU,R.DU,L.BI,P.ZHANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,1587(2010) |
| Literature Reference DOI | 10.1248/cpb.58.1587 |
| Molecular Weight | 606.537 g/mol |
| Source File Reference | UWBT3976 |