| Name |
Botryoxanthin A |
| Formula |
C74H112O2 |
| Mw |
1032.86623282 |
| CAS RN |
173792-78-4 |
| C_ID |
C00022968
, 
|
| InChIKey |
SNYODJNKBVCEKK-ZZSAXZFFNA-N |
| InChICode |
InChI=1S/C74H112O2/c1-53(2)60(10)42-44-63(13)62(12)41-38-57(7)35-27-37-70-73(22,50-48-65(15)64(14)45-43-61(11)54(3)4)76-74(75-70)52-51-72(20,21)69(67(74)17)47-40-59(9)34-26-32-56(6)30-24-23-29-55(5)31-25-33-58(8)39-46-68-66(16)36-28-49-71(68,18)19/h23-26,29-35,39-40,46-47,60-62,65,70H,1,3,13-14,27-28,36-38,41-45,48-52H2,2,4-12,15-22H3/b24-23+,31-25+,32-26+,46-39+,47-40+,55-29+,56-30+,57-35+,58-33+,59-34+/t60-,61+,62+,65-,70-,73+,74-/m0/s1 |
| SMILES |
C=C(C)C(C)CCC(=C)C(C)CC/C(C)=C/CCC1OC2(CCC(C)(C)C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C3=C(C)CCCC3(C)C)=C2C)OC1(C)CCC(C)C(=C)CCC(C)C(=C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Dictyosphaeriaceae | Botryococcus braunii race B strain Berkeley | Ref. |
|
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