| SpectraBase Compound ID | 3VkwPyky0ZV |
|---|---|
| InChI | InChI=1S/2C40H57N7O13S/c2*1-9-21(5)33(51)46-31(20(3)4)38(56)45-29(19-24-11-13-25(48)14-12-24)37(55)47-32-23(7)60-40(58)28(17-18-61(8)59)44-36(54)27(15-16-30(49)50)43-35(53)26(10-2)42-34(52)22(6)41-39(32)57/h2*9-14,20,22-23,27-29,31-32,48H,15-19H2,1-8H3,(H,41,57)(H,42,52)(H,43,53)(H,44,54)(H,45,56)(H,46,51)(H,47,55)(H,49,50)/b2*21-9+,26-10-/t2*22-,23+,27+,28-,29-,31-,32-,61?/m11/s1 |
| InChIKey | ZTOZMCCAKNWANJ-YSHBSUIBSA-N |
| Mol Weight | 1752.0 g/mol |
| Molecular Formula | C80H114N14O26S2 |
| Exact Mass | 1750.747012 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 | G2spTAZHpxi |
|---|---|
| Name | TIGLICAMIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C80H114N14O26S2 |
| InChI | InChI=1S/2C40H57N7O13S/c2*1-9-21(5)33(51)46-31(20(3)4)38(56)45-29(19-24-11-13-25(48)14-12-24)37(55)47-32-23(7)60-40(58)28(17-18-61(8)59)44-36(54)27(15-16-30(49)50)43-35(53)26(10-2)42-34(52)22(6)41-39(32)57/h2*9-14,20,22-23,27-29,31-32,48H,15-19H2,1-8H3,(H,41,57)(H,42,52)(H,43,53)(H,44,54)(H,45,56)(H,46,51)(H,47,55)(H,49,50)/b2*21-9+,26-10-/t2*22-,23+,27+,28-,29-,31-,32-,61?/m11/s1 |
| InChIKey | ZTOZMCCAKNWANJ-YSHBSUIBSA-N |
| Literature Reference Author | S.MATTHEW,V.J.PAUL,H.LUESCH |
| Literature Reference Citation | PHYTOCHEM.,70,2058(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.09.010 |
| Molecular Weight | 1751.983 g/mol |
| Sample ID | 64736 |
| Solvent | DMF-D7 |