| SpectraBase Compound ID | 68QVffbfEas |
|---|---|
| InChI | InChI=1S/C42H57NO3/c1-26-11-9-13-37-39(26,5)19-17-28(3)41(37,7)24-30-21-32(15-16-34(30)44)43-33-23-35(45)31(22-36(33)46)25-42(8)29(4)18-20-40(6)27(2)12-10-14-38(40)42/h15-16,21-23,28-29,37-38,43-44H,1-2,9-14,17-20,24-25H2,3-8H3/t28-,29-,37+,38+,39-,40-,41+,42+/m0/s1 |
| InChIKey | UISGGIHVBSCFEW-FTGWSIDMSA-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 | Anj4TLZSF9d |
|---|---|
| Name | POPOLOHUANONE_F |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H57NO3 |
| InChI | InChI=1S/C42H57NO3/c1-26-11-9-13-37-39(26,5)19-17-28(3)41(37,7)24-30-21-32(15-16-34(30)44)43-33-23-35(45)31(22-36(33)46)25-42(8)29(4)18-20-40(6)27(2)12-10-14-38(40)42/h15-16,21-23,28-29,37-38,43-44H,1-2,9-14,17-20,24-25H2,3-8H3/t28-,29-,37+,38+,39-,40-,41+,42+/m0/s1 |
| InChIKey | UISGGIHVBSCFEW-FTGWSIDMSA-N |
| Literature Reference Author | N.K.UTKINA,V.A.DENISENKO,V.B.KRASOKHIN |
| Literature Reference Citation | J.NAT.PROD.,73,788(2010) |
| Literature Reference DOI | 10.1021/np1000285 |
| Molecular Weight | 623.919 g/mol |
| Sample ID | 35417 |
| Solvent | CDCl3 |