| Properties | Image |
|---|
| MNX_ID | MNXM105320 |
 |
| reference | chebi:69668 |
| formula | C22H28O5 |
| global charge | 0 |
| mol weight | 372.461 |
| InChIKey | JLJAVUZBHSLLJL-RZMCSOMXSA-N |
| InChI | InChI=1S/C22H28O5/c1-13-14(2)22(16-8-10-18(24-4)20(12-16)26-6)27-21(13)15-7-9-17(23-3)19(11-15)25-5/h7-14,21-22H,1-6H3/t13-,14+,21-,22-/m0/s1 |
| SMILES | COC1=C(OC)C=C([C@H]2O[C@H](C3=CC(OC)=C(OC)C=C3)[C@@H](C)[C@H]2C)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C22H28O5/c1-13-14(2)22(16-8-10-18(24-4)20(12-16)26-6)27-21(13)15-7-9-17(23-3)19(11-15)25-5/h7-14,21-22H,1-6H3/t13-,14+,21-,22-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:13]1[C@@H:14]([CH3:2])[C@@H:22]([C:16]2=[CH:12][C:20]([O:26][CH3:6])=[C:18]([O:24][CH3:4])[CH:10]=[CH:8]2)[O:27][C@@H:21]1[C:15]1=[CH:11][C:19]([O:25][CH3:5])=[C:17]([O:23][CH3:3])[CH:9]=[CH:7]1 |
|