| SpectraBase Compound ID | KPK1Fv7yIJQ |
|---|---|
| InChI | InChI=1S/C31H46O5/c1-19(17-32)8-7-9-20(2)22-10-12-29(5)24-16-23-26(21(3)27(34)36-23)31(13-11-25(33)35-6)18-30(24,31)15-14-28(22,29)4/h8,20,22-24,26,32H,3,7,9-18H2,1-2,4-6H3/b19-8+/t20-,22-,23-,24+,26-,28-,29+,30+,31-/m1/s1 |
| InChIKey | LSBCUXSKJRJJJU-PXERRMOCSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C31H46O5 |
| Exact Mass | 498.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 284HCSv9NgN |
|---|---|
| Name | SOOTEPIN_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O5 |
| InChI | InChI=1S/C31H46O5/c1-19(17-32)8-7-9-20(2)22-10-12-29(5)24-16-23-26(21(3)27(34)36-23)31(13-11-25(33)35-6)18-30(24,31)15-14-28(22,29)4/h8,20,22-24,26,32H,3,7,9-18H2,1-2,4-6H3/b19-8+/t20-,22-,23-,24+,26-,28-,29+,30+,31-/m1/s1 |
| InChIKey | LSBCUXSKJRJJJU-PXERRMOCSA-N |
| Literature Reference Author | T.NUANYAI,R.SAPPAPAN,T.TEERAWATANANOND,N.MUANGSIN,K.PUDHORN |
| Literature Reference Citation | J.NAT.PROD.,72,1161(2009) |
| Literature Reference DOI | 10.1021/np900156k |
| Molecular Weight | 498.703 g/mol |
| Sample ID | 33086 |
| Solvent | CDCl3 |