| SpectraBase Compound ID | HGUIrlUTSg0 |
|---|---|
| InChI | InChI=1S/C42H51N7O10/c1-23-37(52)46-30(16-18-36(43)51)41(56)47(3)31(19-25-7-12-28(58-6)13-8-25)39(54)45-24(2)40(55)49(5)33-20-26-9-14-29(15-10-26)59-35-22-27(11-17-34(35)50)21-32(38(53)44-23)48(4)42(33)57/h7-15,17,22-24,30-33,50H,16,18-21H2,1-6H3,(H2,43,51)(H,44,53)(H,45,54)(H,46,52)/t23-,24+,30+,31+,32+,33+/m1/s1 |
| InChIKey | YICIGXQVVJHRDG-YQPHQQCRSA-N |
| Mol Weight | 813.9 g/mol |
| Molecular Formula | C42H51N7O10 |
| Exact Mass | 813.369741 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hox0zd0zAac |
|---|---|
| Name | RA-XXIV;MAJOR-CONFORMER |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H51N7O10 |
| InChI | InChI=1S/C42H51N7O10/c1-23-37(52)46-30(16-18-36(43)51)41(56)47(3)31(19-25-7-12-28(58-6)13-8-25)39(54)45-24(2)40(55)49(5)33-20-26-9-14-29(15-10-26)59-35-22-27(11-17-34(35)50)21-32(38(53)44-23)48(4)42(33)57/h7-15,17,22-24,30-33,50H,16,18-21H2,1-6H3,(H2,43,51)(H,44,53)(H,45,54)(H,46,52)/t23-,24+,30+,31+,32+,33+/m1/s1 |
| InChIKey | YICIGXQVVJHRDG-YQPHQQCRSA-N |
| Literature Reference Author | J.E.LEE,Y.HITOTSUYANAGI,H.FUKAYA,K.KONDO,K.TAKEYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,730(2008) |
| Literature Reference DOI | 10.1248/cpb.56.730 |
| Molecular Weight | 813.908 g/mol |
| Sample ID | 1734 |
| Solvent | C5D5N |