| Name |
Cyclacoumin |
| Formula |
C52H84O23 |
| Mw |
1076.54033899 |
| CAS RN |
186648-68-0 |
| C_ID |
C00050044
, 
|
| InChIKey |
CGUJOULZMVZSJL-ONDWCMSHNA-N |
| InChICode |
InChI=1S/C52H84O23/c1-46(20-55)12-13-51-22-69-52(29(51)14-46)11-7-28-47(2)9-8-31(48(3,21-56)27(47)6-10-49(28,4)50(52,5)15-30(51)58)73-44-40(75-43-39(66)36(63)33(60)24(16-53)70-43)35(62)26(19-68-44)72-45-41(37(64)34(61)25(17-54)71-45)74-42-38(65)32(59)23(57)18-67-42/h20,23-45,53-54,56-66H,6-19,21-22H2,1-5H3/t23-,24-,25-,26+,27-,28-,29-,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47+,48+,49-,50+,51-,52+/m1/s1 |
| SMILES |
C[C@]1(C=O)CC[C@]23CO[C@@]4(CC[C@@H]5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]4(C)C[C@H]2O)[C@@H]3C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Myrsinaceae | Cyclamen mirabile | Ref. |
|
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