| SpectraBase Spectrum ID |
FbeAg96xTo9 |
| Name |
Lindbergin G |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H52O8 |
| InChI |
InChI=1S/C37H52O8/c1-9-11-13-15-27(38)29-32(41)25(31(40)24(34(29)45-8)18-17-22(3)4)21-26-33(42)30(28(39)16-14-12-10-2)36(44)37(7,35(26)43)20-19-23(5)6/h17,19,40-41,43-44H,9-16,18,20-21H2,1-8H3/t37-/m0/s1 |
| InChIKey |
XIAXPJVLENRHKF-QNGWXLTQSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.5b00767 |
| Molecular Weight |
624.815 g/mol |
| Optical Rotation |
[a]22D = -44.6 (c = 1.0, CHCl3) |
| Reported Formula |
C37H52O8 |
| SMILES |
Oc1c(c(c(c(c1CC=1C(C(=C([C@@](C1O)(C)CC=C(C)C)O)C(CCCCC)=O)=O)O)C(=O)CCCCC)OC)CC=C(C)C |
| SPLASH |
splash10-01bi-2497162000-d5095edcac17ec43ef3c |
| Source of Spectrum |
G4-79-SM22-3 |
| Wiley ID |
1849217 |
