| SpectraBase Compound ID | 94gQ5x0HWBW |
|---|---|
| InChI | InChI=1S/C43H60O7/c1-26(2)16-15-21-41(11)29(20-19-27(3)4)23-42-24-33(39(7,8)48)49-36(42)30(22-32-38(5,6)31(25-44)40(9,10)50-32)35(46)43(41,37(42)47)34(45)28-17-13-12-14-18-28/h12-14,16-19,29,31-33,44,48H,15,20-25H2,1-11H3/t29-,31-,32-,33-,41+,42-,43-/m0/s1 |
| InChIKey | MDPGYGAHTYWVFB-QESWIGJASA-N |
| Mol Weight | 688.9 g/mol |
| Molecular Formula | C43H60O7 |
| Exact Mass | 688.433904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVSEe6jvb9L |
|---|---|
| Name | HYPERCOHIN_C |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H60O7 |
| InChI | InChI=1S/C43H60O7/c1-26(2)16-15-21-41(11)29(20-19-27(3)4)23-42-24-33(39(7,8)48)49-36(42)30(22-32-38(5,6)31(25-44)40(9,10)50-32)35(46)43(41,37(42)47)34(45)28-17-13-12-14-18-28/h12-14,16-19,29,31-33,44,48H,15,20-25H2,1-11H3/t29-,31-,32-,33-,41+,42-,43-/m0/s1 |
| InChIKey | MDPGYGAHTYWVFB-QESWIGJASA-N |
| Literature Reference Author | X.LIU,X.W.YANG,C.Q.CHEN,C.Y.WU,J.J.ZHANG,J.Z.MA,H.WANG,L.X.Y ANG,G.XU |
| Literature Reference Citation | J.NAT.PROD.,76,1612(2013) |
| Literature Reference DOI | 10.1021/np400287r |
| Molecular Weight | 688.945 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ43132 |