| SpectraBase Compound ID | 41j5mQreXXr |
|---|---|
| InChI | InChI=1S/C42H57NO3/c1-26-11-9-13-36-39(26,5)19-17-28(3)41(36,7)24-30-21-32(15-16-35(30)45)43-34-23-33(44)22-31(38(34)46)25-42(8)29(4)18-20-40(6)27(2)12-10-14-37(40)42/h11-12,15-16,21-23,28-29,36-37,43,45H,9-10,13-14,17-20,24-25H2,1-8H3/t28-,29+,36+,37-,39+,40-,41+,42-/m1/s1 |
| InChIKey | ROZMQHNIWNVATE-XRDMEJAYSA-N |
| Mol Weight | 623.9 g/mol |
| Molecular Formula | C42H57NO3 |
| Exact Mass | 623.433845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hb6RNUGljCm |
|---|---|
| Name | POPOLOHUALONE-C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H57NO3 |
| InChI | InChI=1S/C42H57NO3/c1-26-11-9-13-36-39(26,5)19-17-28(3)41(36,7)24-30-21-32(15-16-35(30)45)43-34-23-33(44)22-31(38(34)46)25-42(8)29(4)18-20-40(6)27(2)12-10-14-37(40)42/h11-12,15-16,21-23,28-29,36-37,43,45H,9-10,13-14,17-20,24-25H2,1-8H3/t28-,29+,36+,37-,39+,40-,41+,42-/m1/s1 |
| InChIKey | ROZMQHNIWNVATE-XRDMEJAYSA-N |
| Literature Reference Author | K.A.ALVI,M.C.DIAZ,P.CREWS,D.L.SLATE,R.H.LEE,R.MORETTI |
| Literature Reference Citation | J.ORG.CHEM.,57,6604(1992) |
| Literature Reference DOI | 10.1021/jo00050a043 |
| Molecular Weight | 623.919 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS1194 |