| SpectraBase Spectrum ID |
KLCIPnmZnFH |
| Name |
Hyatoquinone - 17,18,21-triacetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
504.272318240 u |
| Formula |
C28H40O8 |
| InChI |
InChI=1S/C28H40O8/c1-16-11-13-28(32)23(10-9-12-26(28,5)6)27(16,7)15-20-24(35-18(3)30)21(33-8)14-22(34-17(2)29)25(20)36-19(4)31/h14,16,23,32H,9-13,15H2,1-8H3 |
| InChIKey |
YXGINXOTCWYISC-UHFFFAOYSA-N |
| Molecular Weight |
504.620 g/mol |
| SMILES |
C=1(C(=C(OC(=O)C)C=C(C1OC(=O)C)OC)OC(=O)C)CC1(C2C(C(C)(C)CCC2)(O)CCC1C)C |
