| Properties | Image | Occurences in reactions |
MNX_ID | MNXM103814 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C27H44O2 |
charge | 0 |
mass | 400.33413 |
reference | metacycM:CPD-14671 |
InChIKey | GXXSUWZCDVJLJJ-SDRJTJMFSA-N |
InChI | InChI=1S/C27H44O2/c1-17(2)6-11-24-27(5,29-24)23-10-9-21-20-8-7-18-16-19(28)12-14-25(18,3)22(20)13-15-26(21,23)4/h7,17,19-24,28H,6,8-16H2,1-5H3/t19-,20-,21-,22-,23-,24?,25-,26-,27+/m0/s1 |
SMILES | CC(C)CCC1O[C@]1(C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C |
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