| Name |
Bruguierin C
(+)-Bruguierin C |
| Formula |
C48H86O6 |
| Mw |
758.64244048 |
| CAS RN |
880162-10-7 |
| C_ID |
C00041403
, 
|
| InChIKey |
PNIOLRUIMUJAKL-BCIYCCHXNA-N |
| InChICode |
InChI=1S/C48H86O6/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-42(50)53-41-35-40(49)48(9)38(44(41,4)5)30-34-46(7)39(48)28-27-36-37(29-33-45(36,46)6)47(8,51)32-25-31-43(2,3)54-52/h25,31,36-41,49,51-52H,10-24,26-30,32-35H2,1-9H3/b31-25+/t36-,37+,38+,39?,40-,41+,45-,46-,47+,48+/m1/s1 |
| SMILES |
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1C[C@@H](O)[C@]2(C)[C@H]3CC[C@@H]4[C@@H]([C@@](C)(O)C/C=C/C(C)(C)OO)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rhizophoraceae | Bruguiera gymmorrhiza | Ref. |
|
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