| Properties | Image | Occurences in reactions |
MNX_ID | MNXM104838 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H24O4 |
charge | 0 |
mass | 352.16746 |
reference | chebi:69316 |
InChIKey | SMOQNODVPACIFX-CZWRZWPQSA-N |
InChI | InChI=1S/C22H24O4/c23-22(24)21-14-6-5-13-16(21)9-15-12(19(14)20(13)15)3-1-2-11-4-7-17-18(8-11)26-10-25-17/h4-8,12-16,19-21H,1-3,9-10H2,(H,23,24)/t12-,13+,14-,15-,16-,19-,20-,21-/m0/s1 |
SMILES | O=C(O)[C@@H]1[C@H]2C[C@H]3[C@H](CCCc4ccc5c(c4)OCO5)[C@H]4[C@@H]1C=C[C@H]2[C@@H]34 |
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