| Name |
Guavacoumaric acid |
| Formula |
C39H54O7 |
| Mw |
634.38695408 |
| CAS RN |
489466-28-6 |
| C_ID |
C00037223
, 
|
| InChIKey |
ADBNLBJPUAZWEK-FCCLUWIPNA-N |
| InChICode |
InChI=1S/C39H54O7/c1-23-15-18-39(34(44)45)20-19-37(5)27(32(39)24(23)2)12-13-30-35(3)21-28(41)33(43)36(4,29(35)16-17-38(30,37)6)22-46-31(42)14-9-25-7-10-26(40)11-8-25/h7-12,14,23-24,28-30,32-33,40-41,43H,13,15-22H2,1-6H3,(H,44,45)/b14-9-/t23-,24+,28-,29-,30-,32+,33+,35+,36-,37-,38-,39+/m1/s1 |
| SMILES |
[C@H]1(CC[C@]2([C@@H]([C@H]1C)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@@H]1[C@@]3(C[C@H]([C@@H]([C@@]1(COC(=O)/C=C\c1ccc(cc1)O)C)O)O)C)C)C(=O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Myrtaceae | Psidium guajava  | Ref. |
|
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