| Properties | Image | Occurences in reactions |
MNX_ID | MNXM147865 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 4 |
in models (compartimentalized) |
0 |
|
formula | C28H50O4 |
charge | 0 |
mass | 450.37091 |
reference | metacycM:CPD-17420 |
InChIKey | QQPPQQNYVDYNAA-VKTWQGKFSA-N |
InChI | InChI=1S/C28H50O4/c1-15(2)16(3)25(31)26(32)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-26,29-32H,7-14H2,1-6H3/t16-,17-,18+,19-,20+,21-,22-,23+,24-,25+,26+,27+,28+/m0/s1 |
SMILES | CC(C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C |
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