| Name |
Cimicinol |
| Formula |
C35H52O8 |
| Mw |
600.36621864 |
| CAS RN |
161239-02-7 |
| C_ID |
C00024134
, 
|
| InChIKey |
AYQRZIHVNBUHFB-ZPUWTCBZNA-N |
| InChICode |
InChI=1S/C35H52O8/c1-18-12-24-29(32(4,5)39)43-35(42-24)17-33(6)14-20-8-10-22-19(13-21(20)15-34(33,7)28(18)35)9-11-25(31(22,2)3)41-30-27(38)26(37)23(36)16-40-30/h8-9,15,18,22-30,36-39H,10-14,16-17H2,1-7H3/t18-,22+,23+,24+,25-,26+,27-,28-,29-,30+,33-,34?,35+/m1/s1 |
| SMILES |
C1[C@H](C([C@@H]2C(=C1)CC1=C[C@@]3([C@](CC1=CC2)(C[C@@]12[C@@H]3[C@@H](C[C@@H]([C@@H](O1)C(O)(C)C)O2)C)C)C)(C)C)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Cimicifuga foetida L.  | Ref. |
|
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