| Properties | Image |
| MNX_ID | MNXM27692 |
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| reference | lipidmapsM:LMPK12140458 |
| formula | C19H20O7 |
| global charge | 0 |
| mol weight | 360.362 |
| InChIKey | KBHNNERSMMYNCG-UHFFFAOYSA-N |
| InChI | InChI=1S/C19H20O7/c1-8-16(22)9(2)18-15(17(8)23)11(20)7-13(26-18)10-5-12(21)19(25-4)14(6-10)24-3/h5-6,13,21-23H,7H2,1-4H3 |
| SMILES | COC1=CC(C2CC(=O)C3=C(O2)C(C)=C(O)C(C)=C3O)=CC(O)=C1OC |
MNX internals
| InChI (mnx) | InChI=1/C19H20O7/c1-8-16(22)9(2)18-15(17(8)23)11(20)7-13(26-18)10-5-12(21)19(25-4)14(6-10)24-3/h5-6,13,21-23H,7H2,1-4H3/t13? |
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| SMILES (mnx) | [CH3:1][C:8]1=[C:16]([OH:22])[C:9]([CH3:2])=[C:18]2[C:15](=[C:17]1[OH:23])[C:11](=[O:20])[CH2:7][CH:13]([C:10]1=[CH:5][C:12]([OH:21])=[C:19]([O:25][CH3:4])[C:14]([O:24][CH3:3])=[CH:6]1)[O:26]2 |
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