| SpectraBase Compound ID | BS7sJy71XX3 |
|---|---|
| InChI | InChI=1S/C55H90O21/c1-26-46(59)35(63-9)21-42(67-26)74-48-29(4)70-44(23-37(48)65-11)76-50-30(5)71-45(24-38(50)66-12)75-49-28(3)69-43(22-36(49)64-10)73-47-27(2)68-41(20-34(47)57)72-33-14-15-51(7)32(19-33)13-16-54(61)39(51)25-40(58)52(8)53(60,31(6)56)17-18-55(52,54)62/h13,26-30,33-50,57-62H,14-25H2,1-12H3/t26-,27-,28-,29-,30-,33-,34+,35+,36+,37+,38+,39?,40+,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,51-,52+,53+,54-,55+/m0/s1 |
| InChIKey | ZDNAXCWQJYAHCL-LIOMRFITSA-N |
| Mol Weight | 1087.3 g/mol |
| Molecular Formula | C55H90O21 |
| Exact Mass | 1086.59746 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 | 2dSZErGuvm7 |
|---|---|
| Name | DEACYLMETAPLEXIGENIN-3-O-ALPHA-CYMAROPYRANOSYL-(1->4)-BETA-CYMAROPYRANOSYL-(1->4)-ALPHA-CYMAROPYRANOSYL-(1->4)-BETA-CYMAROPYRANOSYL-(1->4)- |
| Compound Number | 1O |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H90O21 |
| InChI | InChI=1S/C55H90O21/c1-26-46(59)35(63-9)21-42(67-26)74-48-29(4)70-44(23-37(48)65-11)76-50-30(5)71-45(24-38(50)66-12)75-49-28(3)69-43(22-36(49)64-10)73-47-27(2)68-41(20-34(47)57)72-33-14-15-51(7)32(19-33)13-16-54(61)39(51)25-40(58)52(8)53(60,31(6)56)17-18-55(52,54)62/h13,26-30,33-50,57-62H,14-25H2,1-12H3/t26-,27-,28-,29-,30-,33-,34+,35+,36+,37+,38+,39?,40+,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,51-,52+,53+,54-,55+/m0/s1 |
| InChIKey | ZDNAXCWQJYAHCL-LIOMRFITSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | PHYTOCHEM.,49,2103(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00405-1 |
| Molecular Weight | 1087.307 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU881 |