| Properties | Image |
| MNX_ID | MNXM170494 |
 |
| reference | chebi:125633 |
| formula | C18H27NO3 |
| global charge | 0 |
| mol weight | 305.418 |
| InChIKey | NNGHNWCGIHBKHE-FVQBIDKESA-N |
| InChI | InChI=1S/C18H27NO3/c1-11(2)6-13-10-19-5-4-12-7-17(21)18(22-3)8-14(12)15(19)9-16(13)20/h7-8,11,13,15-16,20-21H,4-6,9-10H2,1-3H3/t13-,15-,16-/m1/s1 |
| SMILES | COC1=C(O)C=C2CCN3C[C@@H](CC(C)C)[C@H](O)C[C@@H]3C2=C1 |
MNX internals
| InChI (mnx) | InChI=1/C18H27NO3/c1-11(2)6-13-10-19-5-4-12-7-17(21)18(22-3)8-14(12)15(19)9-16(13)20/h7-8,11,13,15-16,20-21H,4-6,9-10H2,1-3H3/t13-,15-,16-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:11]([CH3:2])[CH2:6][C@@H:13]1[CH2:10][N:19]2[CH2:5][CH2:4][C:12]3=[CH:7][C:17]([OH:21])=[C:18]([O:22][CH3:3])[CH:8]=[C:14]3[C@H:15]2[CH2:9][C@H:16]1[OH:20] |
|