| Name |
3-O-(E)-Coumaroyl erythrodiol |
| Formula |
C39H56O4 |
| Mw |
588.41786028 |
| CAS RN |
113476-64-5 |
| C_ID |
C00038260
, 
|
| InChIKey |
JIHRTYNJAACOFO-GBTWDFFGNA-N |
| InChICode |
InChI=1S/C39H56O4/c1-34(2)20-22-39(25-40)23-21-37(6)28(29(39)24-34)13-14-31-36(5)18-17-32(35(3,4)30(36)16-19-38(31,37)7)43-33(42)15-10-26-8-11-27(41)12-9-26/h8-13,15,29-32,40-41H,14,16-25H2,1-7H3/b15-10+/t29-,30-,31+,32-,36-,37+,38+,39+/m0/s1 |
| SMILES |
CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)/C=C/c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Casuarinaceae | Casuarina equisetifolia  | Ref. |
|
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