| Properties | Image | Occurences in reactions |
MNX_ID | MNXM106343 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C31H49N3O2 |
charge | 0 |
mass | 495.38248 |
reference | chebi:66604 |
InChIKey | WDJDPNAURLPQIO-QDLVWTCJSA-N |
InChI | InChI=1S/C31H49N3O2/c1-20-14-24(28-10-6-12-33(22(3)35)30(28)16-20)18-26-8-5-9-27(32-26)19-25-15-21(2)17-31-29(25)11-7-13-34(31)23(4)36/h20-21,26-27,30-32H,5-19H2,1-4H3/t20-,21-,26-,27+,30-,31-/m0/s1 |
SMILES | CC(=O)N1CCCC2=C(C[C@@H]3CCC[C@H](CC4=C5CCCN(C(C)=O)[C@H]5C[C@@H](C)C4)N3)C[C@H](C)C[C@@H]21 |
|