| SpectraBase Compound ID | 2l14h4K3juE |
|---|---|
| InChI | InChI=1S/C37H52O3/c1-32(2)28-14-13-27-26(35(28,5)17-16-30(32)40-31(39)25-11-9-8-10-12-25)15-18-37(7)29-23-33(3,24-38)19-20-34(29,4)21-22-36(27,37)6/h8-13,15,28-30,38H,14,16-24H2,1-7H3/t28-,29+,30+,33+,34+,35+,36+,37-/m0/s1 |
| InChIKey | QTSNHJFHQLIOGA-YBTZDMJXSA-N |
| Mol Weight | 544.8 g/mol |
| Molecular Formula | C37H52O3 |
| Exact Mass | 544.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H6jwT1blHVM |
|---|---|
| Name | KAROUNIDIOL-3-O-BENZOATE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H52O3 |
| InChI | InChI=1S/C37H52O3/c1-32(2)28-14-13-27-26(35(28,5)17-16-30(32)40-31(39)25-11-9-8-10-12-25)15-18-37(7)29-23-33(3,24-38)19-20-34(29,4)21-22-36(27,37)6/h8-13,15,28-30,38H,14,16-24H2,1-7H3/t28-,29+,30+,33+,34+,35+,36+,37-/m0/s1 |
| InChIKey | QTSNHJFHQLIOGA-YBTZDMJXSA-N |
| Literature Reference Author | T.SEKIME,H.KURIHARA,M.WAKU,F.IKEGAMI,N.RUANGRUNGSI |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,645(2002) |
| Literature Reference DOI | 10.1248/cpb.50.645 |
| Molecular Weight | 544.818 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN8157 |