| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1113190 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C32H55BrO8 |
charge | 0 |
mass | 646.30803 |
reference | chebi:147397 |
InChIKey | CFIPFJIKZAGWFH-WMYXADBDSA-N |
InChI | InChI=1S/C32H55BrO8/c1-20(34)38-28(4,5)23-14-18-30(7,39-23)22(35)13-16-29(6,36)24-10-11-25-31(8,40-24)19-15-26(37-25)32(9)17-12-21(33)27(2,3)41-32/h21-26,35-36H,10-19H2,1-9H3/t21-,22+,23-,24-,25-,26-,29+,30-,31+,32+/m1/s1 |
SMILES | CC(=O)OC(C)(C)[C@H]1CC[C@](C)([C@@H](O)CC[C@](C)(O)[C@H]2CC[C@H]3O[C@@H]([C@]4(C)CC[C@@H](Br)C(C)(C)O4)CC[C@]3(C)O2)O1 |
|