| Properties | Image |
MNX_ID | MNXM23698 |
 |
reference | lipidmapsM:LMPK12111306 |
formula | C18H16O6 |
global charge | 0 |
mol weight | 328.32 |
InChIKey | KUGNLDQXJCOXDB-UHFFFAOYSA-N |
InChI | InChI=1S/C18H16O6/c1-21-13-7-5-4-6-10(13)14-8-11(19)16-15(22-2)9-12(20)17(23-3)18(16)24-14/h4-9,20H,1-3H3 |
SMILES | COC1=CC=CC=C1C1=CC(=O)C2=C(O1)C(OC)=C(O)C=C2OC |
MNX internals
InChI (mnx) | InChI=1/C18H16O6/c1-21-13-7-5-4-6-10(13)14-8-11(19)16-15(22-2)9-12(20)17(23-3)18(16)24-14/h4-9,20H,1-3H3 |
 |
SMILES (mnx) | [CH3:1][O:21][C:13]1=[CH:7][CH:5]=[CH:4][CH:6]=[C:10]1[C:14]1=[CH:8][C:11](=[O:19])[C:16]2=[C:15]([O:22][CH3:2])[CH:9]=[C:12]([OH:20])[C:17]([O:23][CH3:3])=[C:18]2[O:24]1 |
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