| Name |
Citrusteryl arachidate |
| Formula |
C55H98O7 |
| Mw |
870.73125548 |
| CAS RN |
1236770-07-2 |
| C_ID |
C00054051
|
| InChIKey |
CBLYMGCSIKNWSM-GIEVWACTSA-N |
| InChICode |
InChI=1S/C55H98O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-49(57)62-52-48(38-56)61-53(51(59)50(52)58)60-43-33-35-54(6)42(37-43)29-30-44-46-32-31-45(55(46,7)36-34-47(44)54)40(5)27-28-41(9-2)39(3)4/h29,39-41,43-48,50-53,56,58-59H,8-28,30-38H2,1-7H3/t40-,41-,43+,44+,45-,46+,47+,48-,50-,51-,52-,53-,54+,55-/m1/s1 |
| SMILES |
OC[C@H]1O[C@@H](O[C@@H]2CC3=CC[C@]([C@@](CC[C@]4([H])[C@H](C)CC[C@@H](CC)C(C)C)([H])[C@]4(C)CC5)([H])[C@@]5([H])[C@@]3(C)CC2)[C@H](O)[C@@H](O)[C@@H]1OC(CCCCCCCCCCCCCCCCCCC)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus reticulata  | Ref. |
|
|
zoom in
| Organism | Citrus reticulata |
|---|
| Reference | Aldrich Library of FT-IR Spectra, 1st edn.,1985, 2, 1048C (ir) |
|---|
|
