| Properties | Image | Occurences in reactions |
MNX_ID | MNXM107340 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C33H46N2O4 |
charge | 0 |
mass | 534.34576 |
reference | chebi:70422 |
InChIKey | FBMFMDSVTBIJPB-CKTRUMDJSA-N |
InChI | InChI=1S/C33H46N2O4/c1-20(35(5)6)27-25(37)18-32(4)23-16-24(36)28-30(2)19-39-33(28,17-22(23)12-14-31(27,32)3)15-13-26(30)34-29(38)21-10-8-7-9-11-21/h7-13,15,20,23-28,36-37H,14,16-19H2,1-6H3,(H,34,38)/t20-,23+,24-,25+,26-,27-,28-,30+,31+,32-,33+/m0/s1 |
SMILES | C[C@@H]([C@H]1[C@H](O)C[C@@]2(C)[C@@H]3C[C@H](O)[C@@H]4[C@@]5(C=C[C@H](NC(=O)c6ccccc6)[C@@]4(C)CO5)CC3=CC[C@]12C)N(C)C |
|