![KAEMPFEROL-3-O-[6'''-O-SINAPOYL-BETA-D-GLUCOPYRANOSYL]-(1->2)-BETA-D-GALACTOPYRANOSIDE](/api/spectrum/JVSI1qtqAbc/structure.png?h=300&w=458 "KAEMPFEROL-3-O-[6'''-O-SINAPOYL-BETA-D-GLUCOPYRANOSYL]-(1->2)-BETA-D-GALACTOPYRANOSIDE")
| SpectraBase Compound ID | J33VolwMnr0 |
|---|---|
| InChI | InChI=1S/C38H40O20/c1-51-21-9-15(10-22(52-2)27(21)44)3-8-25(43)53-14-24-29(46)31(48)33(50)37(56-24)58-36-32(49)28(45)23(13-39)55-38(36)57-35-30(47)26-19(42)11-18(41)12-20(26)54-34(35)16-4-6-17(40)7-5-16/h3-12,23-24,28-29,31-33,36-42,44-46,48-50H,13-14H2,1-2H3/b8-3+/t23-,24-,28+,29-,31+,32+,33-,36-,37+,38+/m1/s1 |
| InChIKey | GCZWMUSXVIZQRI-HHEZHDPJSA-N |
| Mol Weight | 816.7 g/mol |
| Molecular Formula | C38H40O20 |
| Exact Mass | 816.211294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JVSI1qtqAbc |
|---|---|
| Name | KAEMPFEROL-3-O-[6'''-O-SINAPOYL-BETA-D-GLUCOPYRANOSYL]-(1->2)-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H40O20 |
| InChI | InChI=1S/C38H40O20/c1-51-21-9-15(10-22(52-2)27(21)44)3-8-25(43)53-14-24-29(46)31(48)33(50)37(56-24)58-36-32(49)28(45)23(13-39)55-38(36)57-35-30(47)26-19(42)11-18(41)12-20(26)54-34(35)16-4-6-17(40)7-5-16/h3-12,23-24,28-29,31-33,36-42,44-46,48-50H,13-14H2,1-2H3/b8-3+/t23-,24-,28+,29-,31+,32+,33-,36-,37+,38+/m1/s1 |
| InChIKey | GCZWMUSXVIZQRI-HHEZHDPJSA-N |
| Literature Reference Author | F.ABE,Y.IWASE,T.YAMAUCHI,S.YAHARA,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,40,577(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00316-Y |
| Molecular Weight | 816.724 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN3617 |