| SpectraBase Compound ID | 8wXkKiNrInK |
|---|---|
| InChI | InChI=1S/C31H48O6/c1-17(2)10-9-11-18(3)19-12-13-28(4)25-20(32)14-22-30(6,26(25)21(37-8)16-29(19,28)5)23(33)15-24(34)31(22,7)27(35)36/h10,18-19,21-24,33-34H,9,11-16H2,1-8H3,(H,35,36)/t18?,19-,21-,22-,23-,24+,28+,29-,30-,31?/m1/s1 |
| InChIKey | IDJOIVLQLLXEIY-IYYZIJEBSA-N |
| Mol Weight | 516.7 g/mol |
| Molecular Formula | C31H48O6 |
| Exact Mass | 516.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HzJKylyWHay |
|---|---|
| Name | FOMITELLIC-ACID-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O6 |
| InChI | InChI=1S/C31H48O6/c1-17(2)10-9-11-18(3)19-12-13-28(4)25-20(32)14-22-30(6,26(25)21(37-8)16-29(19,28)5)23(33)15-24(34)31(22,7)27(35)36/h10,18-19,21-24,33-34H,9,11-16H2,1-8H3,(H,35,36)/t18?,19-,21-,22-,23-,24+,28+,29-,30-,31?/m1/s1 |
| InChIKey | IDJOIVLQLLXEIY-IYYZIJEBSA-N |
| Literature Reference Author | N.TANAKA,A.KITAMURA,Y.MIZUSHINA,F.SUGAWARA,K.SAKAGUCHI |
| Literature Reference Citation | J.NAT.PROD.,61,193(1998) |
| Literature Reference DOI | 10.1021/np970127a |
| Molecular Weight | 516.719 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP545 |