| Name |
Beciumecine 1 |
| Formula |
C63H102O31 |
| Mw |
1354.64050655 |
| CAS RN |
220788-69-2 |
| C_ID |
C00040895
, 
|
| InChIKey |
CSVOJBHLRRLOJX-WWQCJSJJNA-N |
| InChICode |
InChI=1S/C63H102O31/c1-24-34(71)37(74)39(76)51(86-24)90-44-31(70)20-83-50(41(44)78)89-43-25(2)87-53(42(79)45(43)91-55-48(80)63(82,22-66)23-85-55)92-46-35(72)30(69)19-84-54(46)94-56(81)62-13-11-57(3,4)15-27(62)26-9-10-33-58(5)16-29(68)49(93-52-40(77)38(75)36(73)32(18-64)88-52)59(6,21-65)47(58)28(67)17-61(33,8)60(26,7)12-14-62/h9,24-25,27-55,64-80,82H,10-23H2,1-8H3/t24-,25-,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-,53-,54-,55-,58+,59-,60+,61+,62-,63+/m0/s1 |
| SMILES |
[C@@H]1([C@@H]([C@@]([C@H]2[C@](C1)([C@@H]1[C@@](C[C@H]2O)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)O[C@@H]1OC[C@@]([C@H]1O)(CO)O)O)O)O)C)C)C)(C)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Lamiaceae | Becium grandiflorum var.obovatum | Ref. |
|
|
zoom in
|
