![PRECATORIN-III;6-C-[BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-4',5-DIHYDROXY-7-METHOXY-FLAVONE](/api/spectrum/DRQZNxS8yu7/structure.png?h=300&w=458 "PRECATORIN-III;6-C-[BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-4',5-DIHYDROXY-7-METHOXY-FLAVONE")
| SpectraBase Compound ID | 2Vsabif1QFs |
|---|---|
| InChI | InChI=1S/2C27H30O14/c2*1-37-15-7-16-18(13(31)6-14(39-16)11-2-4-12(30)5-3-11)21(33)19(15)23-24(22(34)20(32)17(8-28)40-23)41-26-25(35)27(36,9-29)10-38-26/h2*2-7,17,20,22-26,28-30,32-36H,8-10H2,1H3/t2*17-,20-,22+,23+,24-,25+,26+,27-/m00/s1 |
| InChIKey | PLRUWUYSJVSLBA-HTTZOMBASA-N |
| Mol Weight | 1157.05 g/mol |
| Molecular Formula | C54H60O28 |
| Exact Mass | 1156.327111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DRQZNxS8yu7 |
|---|---|
| Name | PRECATORIN-III;6-C-[BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-4',5-DIHYDROXY-7-METHOXY-FLAVONE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H60O28 |
| InChI | InChI=1S/2C27H30O14/c2*1-37-15-7-16-18(13(31)6-14(39-16)11-2-4-12(30)5-3-11)21(33)19(15)23-24(22(34)20(32)17(8-28)40-23)41-26-25(35)27(36,9-29)10-38-26/h2*2-7,17,20,22-26,28-30,32-36H,8-10H2,1H3/t2*17-,20-,22+,23+,24-,25+,26+,27-/m00/s1 |
| InChIKey | PLRUWUYSJVSLBA-HTTZOMBASA-N |
| Literature Reference Author | C.M.MA,N.NAKAMURA,M.HATTORI |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,982(1998) |
| Literature Reference DOI | 10.1248/cpb.46.982 |
| Molecular Weight | 1157.054 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS6484 |