![MALVIDIN_3-O-[6-(II)-O-(4''''-O-MALONYL-ALPHA-RHAMNOPYRANOSYL)-BETA-GLUCOPYRANOSIDE]-5-O-BETA-GLUCOPYRANOSIDE](/api/spectrum/2aiEDVUc0d/structure.png?h=300&w=458 "MALVIDIN_3-O-[6-(II)-O-(4''''-O-MALONYL-ALPHA-RHAMNOPYRANOSYL)-BETA-GLUCOPYRANOSIDE]-5-O-BETA-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 63qhthy7Y0a |
|---|---|
| InChI | InChI=1S/C38H46O24/c1-12-34(62-24(43)9-23(41)42)30(49)33(52)36(56-12)55-11-22-27(46)29(48)32(51)38(61-22)59-20-8-15-16(57-35(20)13-4-18(53-2)25(44)19(5-13)54-3)6-14(40)7-17(15)58-37-31(50)28(47)26(45)21(10-39)60-37/h4-8,12,21-22,26-34,36-39,45-52H,9-11H2,1-3H3,(H2-,40,41,42,44)/p+1/t12-,21-,22+,26-,27+,28+,29-,30-,31-,32+,33+,34-,36+,37-,38+/m1/s1 |
| InChIKey | HVQCUCVOZXRGOG-KGFWDMPASA-O |
| Mol Weight | 887.8 g/mol |
| Molecular Formula | C38H47O24 |
| Exact Mass | 887.245727 g/mol |
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| SpectraBase Spectrum ID | 2aiEDVUc0d |
|---|---|
| Name | MALVIDIN_3-O-[6-(II)-O-(4''''-O-MALONYL-ALPHA-RHAMNOPYRANOSYL)-BETA-GLUCOPYRANOSIDE]-5-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H47O24 |
| InChI | InChI=1S/C38H46O24/c1-12-34(62-24(43)9-23(41)42)30(49)33(52)36(56-12)55-11-22-27(46)29(48)32(51)38(61-22)59-20-8-15-16(57-35(20)13-4-18(53-2)25(44)19(5-13)54-3)6-14(40)7-17(15)58-37-31(50)28(47)26(45)21(10-39)60-37/h4-8,12,21-22,26-34,36-39,45-52H,9-11H2,1-3H3,(H2-,40,41,42,44)/p+1/t12-,21-,22+,26-,27+,28+,29-,30-,31-,32+,33+,34-,36+,37-,38+/m1/s1 |
| InChIKey | HVQCUCVOZXRGOG-KGFWDMPASA-O |
| Literature Reference Author | T.FOSSEN,S.RAYYAN,M.H.HOLMBERG,H.S.NATELAND,O.M.ANDERSEN |
| Literature Reference Citation | PHYTOCHEM.,66,1133(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.04.009 |
| Molecular Weight | 887.777 g/mol |
| Solvent | CF3COOD:CD3OD=5:95 |
| Source File Reference | UWMZ22303 |