| SpectraBase Compound ID | HeZzjvPe6PK |
|---|---|
| InChI | InChI=1S/C39H50O20/c1-13(2)19(41)10-18-21(55-38-32(51)29(48)26(45)22(12-40)56-38)11-20(42)23-27(46)35(33(57-34(18)23)16-6-8-17(52-5)9-7-16)58-39-36(30(49)25(44)15(4)54-39)59-37-31(50)28(47)24(43)14(3)53-37/h6-9,11,14-15,19,22,24-26,28-32,36-45,47-51H,1,10,12H2,2-5H3/t14-,15-,19?,22-,24-,25-,26-,28+,29+,30+,31+,32-,36+,37-,38-,39-/m0/s1 |
| InChIKey | MIMVORVNCSRFSW-QYXIXGFFSA-N |
| Mol Weight | 838.8 g/mol |
| Molecular Formula | C39H50O20 |
| Exact Mass | 838.289544 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DCHvVDCI6hi |
|---|---|
| Name | #1;SAGITTASINE-A;4'-METHOXY-5-HYDROXY-8-(2-HYDROXY-3-METHYL-3-BUTENYL)-FLAVONE-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSIDE-7-O-BETA-D-GLUCOPYRA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50O20 |
| InChI | InChI=1S/C39H50O20/c1-13(2)19(41)10-18-21(55-38-32(51)29(48)26(45)22(12-40)56-38)11-20(42)23-27(46)35(33(57-34(18)23)16-6-8-17(52-5)9-7-16)58-39-36(30(49)25(44)15(4)54-39)59-37-31(50)28(47)24(43)14(3)53-37/h6-9,11,14-15,19,22,24-26,28-32,36-45,47-51H,1,10,12H2,2-5H3/t14-,15-,19?,22-,24-,25-,26-,28+,29+,30+,31+,32-,36+,37-,38-,39-/m0/s1 |
| InChIKey | MIMVORVNCSRFSW-QYXIXGFFSA-N |
| Literature Reference Author | G.J.WANG,T.H.TSAI,L.C.LIN |
| Literature Reference Citation | PHYTOCHEM.,68,2455(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.05.035 |
| Molecular Weight | 838.814 g/mol |
| Sample ID | 43386 |
| Solvent | CD3OD |