| Properties | Image | Occurences in reactions |
MNX_ID | MNXM167892 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C23H27O6 |
charge | -1 |
mass | 399.18131 |
reference | metacycM:CPD-18430 |
InChIKey | FVRDNLIUSWSBCT-UFZXEYFSSA-M |
InChI | InChI=1S/C23H28O6/c1-15-10-11-21(2)16(12-15)28-18-13-17(22(21,3)23(18)14-27-23)29-20(26)9-7-5-4-6-8-19(24)25/h4-9,12,16-18H,10-11,13-14H2,1-3H3,(H,24,25)/p-1/b5-4+,8-6+,9-7-/t16-,17-,18-,21+,22-,23?/m1/s1 |
SMILES | CC1=C[C@H]2O[C@@H]3C[C@@H](OC(=O)/C=C\C=C\C=C\C(=O)[O-])[C@@](C)(C34CO4)[C@@]2(C)CC1 |
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