| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1100871 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C26H32ClN2O3 |
charge | 1 |
mass | 455.2096 |
reference | seedM:cpd35372 |
InChIKey | GGVBZXJWJSHURB-OODLVNIASA-N |
InChI | InChI=1S/C26H32ClN2O3/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20(30)21(31)26(24,28-7)25(15,18)32/h7-11,15-16,20-21,29-32H,1,12H2,2-6H3/q+1/t15-,16-,20+,21+,24+,25-,26+/m1/s1 |
SMILES | C#[N+][C@]12[C@@H](O)[C@H](O)C(C)(C)c3[nH]c4cccc5c4c3[C@]1(O)[C@H](C[C@@H](Cl)[C@]2(C)C=C)C5(C)C |
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