| Properties | Image |
MNX_ID | MNXM102119 |
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reference | chebi:66366 |
formula | C19H18O6 |
global charge | 0 |
mol weight | 342.347 |
InChIKey | DNYSLSNXLMFTTC-UHFFFAOYSA-N |
InChI | InChI=1S/C19H18O6/c1-8-19(2,3)14-12(24-8)7-10(20)13-15(21)9-5-6-11(23-4)16(22)17(9)25-18(13)14/h5-8,20,22H,1-4H3 |
SMILES | COC1=CC=C2C(=O)C3=C(O)C=C4OC(C)C(C)(C)C4=C3OC2=C1O |
MNX internals
InChI (mnx) | InChI=1/C19H18O6/c1-8-19(2,3)14-12(24-8)7-10(20)13-15(21)9-5-6-11(23-4)16(22)17(9)25-18(13)14/h5-8,20,22H,1-4H3/t8? |
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SMILES (mnx) | [CH3:1][CH:8]1[C:19]([CH3:2])([CH3:3])[C:14]2=[C:18]3[C:13](=[C:10]([OH:20])[CH:7]=[C:12]2[O:24]1)[C:15](=[O:21])[C:9]1=[C:17]([C:16]([OH:22])=[C:11]([O:23][CH3:4])[CH:6]=[CH:5]1)[O:25]3 |
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