| Properties | Image |
| MNX_ID | MNXM164397 |
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| reference | metacycM:CPD-18185 |
| formula | C16H16O7 |
| global charge | 0 |
| mol weight | 320.297 |
| InChIKey | YPNXOCUYGUZFEQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H16O7/c1-7(18)4-8-9(6-17)15(20)12-10(22-2)5-11(23-3)16(21)13(12)14(8)19/h5-6,19-21H,4H2,1-3H3 |
| SMILES | COC1=CC(OC)=C(O)C2=C1C(O)=C(C=O)C(CC(C)=O)=C2O |
MNX internals
| InChI (mnx) | InChI=1/C16H16O7/c1-7(18)4-8-9(6-17)15(20)12-10(22-2)5-11(23-3)16(21)13(12)14(8)19/h5-6,19-21H,4H2,1-3H3 |
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| SMILES (mnx) | [CH3:1][C:7]([CH2:4][C:8]1=[C:14]([OH:19])[C:13]2=[C:12]([C:10]([O:22][CH3:2])=[CH:5][C:11]([O:23][CH3:3])=[C:16]2[OH:21])[C:15]([OH:20])=[C:9]1[CH:6]=[O:17])=[O:18] |
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