| Properties | Image | Occurences in reactions |
MNX_ID | MNXM164171 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
0 |
|
formula | C21H28O4 |
charge | 0 |
mass | 344.19876 |
reference | sabiorkM:26669 |
InChIKey | DKDACGRLOGBANH-HJTSIMOOSA-N |
InChI | InChI=1S/C21H28O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,11,14-17,19,24H,3-8,10H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1 |
SMILES | C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)C=O |
|