| Properties | Image |
|---|
| MNX_ID | MNXM55905 |
 |
| reference | chebi:81123 |
| formula | C15H16O5 |
| global charge | 0 |
| mol weight | 276.288 |
| InChIKey | VOTLUFSYIRHICX-LBPRGKRZSA-N |
| InChI | InChI=1S/C15H16O5/c1-7-4-9(16)13-11(19-7)6-10-8(14(13)18)5-12(17)15(2,3)20-10/h4,6,12,17-18H,5H2,1-3H3/t12-/m0/s1 |
| SMILES | CC1=CC(=O)C2=C(O)C3=C(C=C2O1)OC(C)(C)[C@@H](O)C3 |
MNX internals
| InChI (mnx) | InChI=1/C15H16O5/c1-7-4-9(16)13-11(19-7)6-10-8(14(13)18)5-12(17)15(2,3)20-10/h4,6,12,17-18H,5H2,1-3H3/t12-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:7]1=[CH:4][C:9](=[O:16])[C:13]2=[C:11]([CH:6]=[C:10]3[C:8](=[C:14]2[OH:18])[CH2:5][C@H:12]([OH:17])[C:15]([CH3:2])([CH3:3])[O:20]3)[O:19]1 |
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