![ISORHAMNETIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/GU6Rr0KsjGq/structure.png?h=300&w=458 "ISORHAMNETIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 4lMLC3N8uOg |
|---|---|
| InChI | InChI=1S/C34H40O20/c1-12-23(41)26(44)28(46)32(50-12)54-31-27(45)24(42)19(11-49-21(40)10-34(2,47)9-20(38)39)52-33(31)53-30-25(43)22-16(37)7-14(35)8-18(22)51-29(30)13-4-5-15(36)17(6-13)48-3/h4-8,12,19,23-24,26-28,31-33,35-37,41-42,44-47H,9-11H2,1-3H3,(H,38,39)/t12-,19-,23-,24-,26+,27+,28+,31-,32-,33+,34+/m1/s1 |
| InChIKey | JXTIZVSLTAYLLT-CPGWWEIFSA-N |
| Mol Weight | 768.7 g/mol |
| Molecular Formula | C34H40O20 |
| Exact Mass | 768.211294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GU6Rr0KsjGq |
|---|---|
| Name | ISORHAMNETIN-3-O-[(S)-3-HYDROXY-3-METHYL-GLUTAROYL-(1->6)]-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H40O20 |
| InChI | InChI=1S/C34H40O20/c1-12-23(41)26(44)28(46)32(50-12)54-31-27(45)24(42)19(11-49-21(40)10-34(2,47)9-20(38)39)52-33(31)53-30-25(43)22-16(37)7-14(35)8-18(22)51-29(30)13-4-5-15(36)17(6-13)48-3/h4-8,12,19,23-24,26-28,31-33,35-37,41-42,44-47H,9-11H2,1-3H3,(H,38,39)/t12-,19-,23-,24-,26+,27+,28+,31-,32-,33+,34+/m1/s1 |
| InChIKey | JXTIZVSLTAYLLT-CPGWWEIFSA-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 | 768.680 g/mol |
| Source File Reference | UWBT3977 |