| Properties | Image |
|---|
| MNX_ID | MNXM1180123 |
 |
| reference | envipathM:...da289bb76c1c |
| formula | C26H28O9 |
| global charge | 0 |
| mol weight | 484.501 |
| InChIKey | WQAFQUNIXZCIBU-XDHOZWIPSA-N |
| InChI | InChI=1S/C26H28O9/c1-5-6-7-17-14(2)16-9-8-15(10-22(16)35-26(17)31)34-13-18-23(19(12-32-3)25(30)33-4)20(27)11-21(28)24(18)29/h8-12,27-29H,5-7,13H2,1-4H3/b19-12+ |
| SMILES | CCCCC1=C(C)C2=C(C=C(OCC3=C(O)C(O)=CC(O)=C3/C(=C\OC)C(=O)OC)C=C2)OC1=O |
MNX internals
| InChI (mnx) | InChI=1/C26H28O9/c1-5-6-7-17-14(2)16-9-8-15(10-22(16)35-26(17)31)34-13-18-23(19(12-32-3)25(30)33-4)20(27)11-21(28)24(18)29/h8-12,27-29H,5-7,13H2,1-4H3/b19-12+ |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:6][CH2:7][C:17]1=[C:14]([CH3:2])[C:16]2=[C:22]([CH:10]=[C:15]([O:34][CH2:13][C:18]3=[C:23](/[C:19](=[CH:12]\[O:32][CH3:3])[C:25](=[O:30])[O:33][CH3:4])[C:20]([OH:27])=[CH:11][C:21]([OH:28])=[C:24]3[OH:29])[CH:8]=[CH:9]2)[O:35][C:26]1=[O:31] |
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