| Properties | Image |
|---|
| MNX_ID | MNXM30133 |
 |
| reference | chebi:50944 |
| formula | C21H18O7 |
| global charge | 0 |
| mol weight | 382.368 |
| InChIKey | ZLULUXWJVBHEMS-FNEOHHHZSA-N |
| InChI | InChI=1S/C21H18O7/c1-4-5-14-7-12-8-17(24)21(3,19(25)15(12)10-27-14)28-20(26)18-11(2)6-13(22)9-16(18)23/h4-10,22-23H,1-3H3/b5-4+/t21-/m0/s1 |
| SMILES | C/C=C/C1=CC2=CC(=O)[C@](C)(OC(=O)C3=C(C)C=C(O)C=C3O)C(=O)C2=CO1 |
MNX internals
| InChI (mnx) | InChI=1/C21H18O7/c1-4-5-14-7-12-8-17(24)21(3,19(25)15(12)10-27-14)28-20(26)18-11(2)6-13(22)9-16(18)23/h4-10,22-23H,1-3H3/b5-4+/t21-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1]/[CH:4]=[CH:5]/[C:14]1=[CH:7][C:12]2=[CH:8][C:17](=[O:24])[C@:21]([CH3:3])([O:28][C:20]([C:18]3=[C:16]([OH:23])[CH:9]=[C:13]([OH:22])[CH:6]=[C:11]3[CH3:2])=[O:26])[C:19](=[O:25])[C:15]2=[CH:10][O:27]1 |
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