| Properties | Image |
| MNX_ID | MNXM101108 |
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| reference | chebi:70655 |
| formula | C18H18O5 |
| global charge | 0 |
| mol weight | 314.337 |
| InChIKey | HTDSMOBGCNRBHQ-RMKNXTFCSA-N |
| InChI | InChI=1S/C18H18O5/c1-10-16(21)11(2)18(23-3)15(17(10)22)14(20)9-6-12-4-7-13(19)8-5-12/h4-9,19,21-22H,1-3H3/b9-6+ |
| SMILES | COC1=C(C)C(O)=C(C)C(O)=C1C(=O)/C=C/C1=CC=C(O)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C18H18O5/c1-10-16(21)11(2)18(23-3)15(17(10)22)14(20)9-6-12-4-7-13(19)8-5-12/h4-9,19,21-22H,1-3H3/b9-6+ |
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| SMILES (mnx) | [CH3:1][C:10]1=[C:16]([OH:21])[C:11]([CH3:2])=[C:18]([O:23][CH3:3])[C:15]([C:14](/[CH:9]=[CH:6]/[C:12]2=[CH:5][CH:8]=[C:13]([OH:19])[CH:7]=[CH:4]2)=[O:20])=[C:17]1[OH:22] |
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