| Properties | Image |
MNX_ID | MNXM114341 |
 |
reference | metacycM:CPD-14861 |
formula | C19H18O9 |
global charge | 0 |
mol weight | 390.344 |
InChIKey | JUMXNPKEKATCOD-UHFFFAOYSA-N |
InChI | InChI=1S/C19H18O9/c1-24-9-6-5-8(13(20)14(9)21)17-19(27-4)16(23)12-10(28-17)7-11(25-2)18(26-3)15(12)22/h5-7,20-22H,1-4H3 |
SMILES | COC1=CC=C(C2=C(OC)C(=O)C3=C(O)C(OC)=C(OC)C=C3O2)C(O)=C1O |
MNX internals
InChI (mnx) | InChI=1/C19H18O9/c1-24-9-6-5-8(13(20)14(9)21)17-19(27-4)16(23)12-10(28-17)7-11(25-2)18(26-3)15(12)22/h5-7,20-22H,1-4H3 |
 |
SMILES (mnx) | [CH3:1][O:24][C:9]1=[C:14]([OH:21])[C:13]([OH:20])=[C:8]([C:17]2=[C:19]([O:27][CH3:4])[C:16](=[O:23])[C:12]3=[C:15]([OH:22])[C:18]([O:26][CH3:3])=[C:11]([O:25][CH3:2])[CH:7]=[C:10]3[O:28]2)[CH:5]=[CH:6]1 |
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