![#11;5-ACETYLOXY-2-(3,4-DIACETYLOXYPHENYL)-7-METHOXY-3-[[2-O-(TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OXY]-4H-1-BENZOPYRAN](/api/spectrum/JqF2YfFH06H/structure.png?h=300&w=458 "#11;5-ACETYLOXY-2-(3,4-DIACETYLOXYPHENYL)-7-METHOXY-3-[[2-O-(TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OXY]-4H-1-BENZOPYRAN")
| SpectraBase Compound ID | E898ykG1GQq |
|---|---|
| InChI | InChI=1S/C46H50O25/c1-18-37(63-23(6)51)41(65-25(8)53)43(67-27(10)55)45(59-18)71-44-42(66-26(9)54)39(64-24(7)52)34(17-58-19(2)47)69-46(44)70-40-36(56)35-32(62-22(5)50)15-29(57-11)16-33(35)68-38(40)28-12-13-30(60-20(3)48)31(14-28)61-21(4)49/h12-16,18,34,37,39,41-46H,17H2,1-11H3/t18-,34+,37-,39+,41+,42-,43+,44+,45-,46-/m1/s1 |
| InChIKey | UTAUENQDYHLYLW-DLCHAKCRSA-N |
| Mol Weight | 1002.9 g/mol |
| Molecular Formula | C46H50O25 |
| Exact Mass | 1002.264117 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JqF2YfFH06H |
|---|---|
| Name | #11;5-ACETYLOXY-2-(3,4-DIACETYLOXYPHENYL)-7-METHOXY-3-[[2-O-(TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL]-OXY]-4H-1-BENZOPYRAN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H50O25 |
| InChI | InChI=1S/C46H50O25/c1-18-37(63-23(6)51)41(65-25(8)53)43(67-27(10)55)45(59-18)71-44-42(66-26(9)54)39(64-24(7)52)34(17-58-19(2)47)69-46(44)70-40-36(56)35-32(62-22(5)50)15-29(57-11)16-33(35)68-38(40)28-12-13-30(60-20(3)48)31(14-28)61-21(4)49/h12-16,18,34,37,39,41-46H,17H2,1-11H3/t18-,34+,37-,39+,41+,42-,43+,44+,45-,46-/m1/s1 |
| InChIKey | UTAUENQDYHLYLW-DLCHAKCRSA-N |
| Literature Reference Author | N.M.PAULI,U.SEQUIN |
| Literature Reference Citation | MOLECULES,1,15(1996) |
| Literature Reference DOI | 10.1007/s007830050003 |
| Molecular Weight | 1002.888 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP3978 |