| SpectraBase Compound ID | 3uc3mXwhJma |
|---|---|
| InChI | InChI=1S/C59H94O24/c1-13-26(2)53(67)79-40-24-39-56(8)17-15-33(20-32(56)14-18-58(39,68)59(69)19-16-34(27(3)61)57(40,59)9)77-41-21-35(62)48(28(4)73-41)80-42-22-36(70-10)49(29(5)74-42)81-43-23-37(71-11)50(30(6)75-43)82-55-47(66)52(72-12)51(31(7)76-55)83-54-46(65)45(64)44(63)38(25-60)78-54/h13-14,28-31,33-52,54-55,60,62-66,68-69H,15-25H2,1-12H3/b26-13+/t28-,29-,30+,31-,33-,34-,35+,36+,37+,38+,39+,40+,41+,42+,43-,44+,45-,46+,47-,48-,49-,50+,51-,52-,54-,55+,56-,57-,58-,59+/m0/s1 |
| InChIKey | TWYOLDOHPUOANR-GDYIRVRMSA-N |
| Mol Weight | 1187.4 g/mol |
| Molecular Formula | C59H94O24 |
| Exact Mass | 1186.613504 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 725hS3UTzF4 |
|---|---|
| Name | 12-O-TIGLOYLISOLINEOLON-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-THEVETOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANO |
| Compound Number | 24 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H94O24 |
| InChI | InChI=1S/C59H94O24/c1-13-26(2)53(67)79-40-24-39-56(8)17-15-33(20-32(56)14-18-58(39,68)59(69)19-16-34(27(3)61)57(40,59)9)77-41-21-35(62)48(28(4)73-41)80-42-22-36(70-10)49(29(5)74-42)81-43-23-37(71-11)50(30(6)75-43)82-55-47(66)52(72-12)51(31(7)76-55)83-54-46(65)45(64)44(63)38(25-60)78-54/h13-14,28-31,33-52,54-55,60,62-66,68-69H,15-25H2,1-12H3/b26-13+/t28-,29-,30+,31-,33-,34-,35+,36+,37+,38+,39+,40+,41+,42+,43-,44+,45-,46+,47-,48-,49-,50+,51-,52-,54-,55+,56-,57-,58-,59+/m0/s1 |
| InChIKey | TWYOLDOHPUOANR-GDYIRVRMSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,516(2000) |
| Literature Reference DOI | 10.1248/cpb.48.516 |
| Molecular Weight | 1187.381 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU5038 |