| Properties | Image |
| MNX_ID | MNXM27950 |
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| reference | lipidmapsM:LMPK12050347 |
| formula | C22H22O6 |
| global charge | 0 |
| mol weight | 382.412 |
| InChIKey | UWXYUEZCGLSJLG-UHFFFAOYSA-N |
| InChI | InChI=1S/C22H22O6/c1-12(2)5-6-13-7-14(8-17(24)22(13)27-4)16-11-28-19-10-15(23)9-18(26-3)20(19)21(16)25/h5,7-11,23-24H,6H2,1-4H3 |
| SMILES | COC1=C2C(=O)C(C3=CC(O)=C(OC)C(CC=C(C)C)=C3)=COC2=CC(O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C22H22O6/c1-12(2)5-6-13-7-14(8-17(24)22(13)27-4)16-11-28-19-10-15(23)9-18(26-3)20(19)21(16)25/h5,7-11,23-24H,6H2,1-4H3 |
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| SMILES (mnx) | [CH3:1][C:12]([CH3:2])=[CH:5][CH2:6][C:13]1=[CH:7][C:14]([C:16]2=[CH:11][O:28][C:19]3=[CH:10][C:15]([OH:23])=[CH:9][C:18]([O:26][CH3:3])=[C:20]3[C:21]2=[O:25])=[CH:8][C:17]([OH:24])=[C:22]1[O:27][CH3:4] |
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