| Name |
Caffeoylcycloartenol |
| Formula |
C39H56O4 |
| Mw |
588.41786028 |
| CAS RN |
75884-34-3 |
| C_ID |
C00054285
|
| InChIKey |
QKNCKSQAXGWPIK-YFRHIOQFSA-N |
| InChICode |
InChI=1S/C39H56O4/c1-25(2)9-8-10-26(3)28-17-19-37(7)32-15-14-31-35(4,5)33(18-20-38(31)24-39(32,38)22-21-36(28,37)6)43-34(42)16-12-27-11-13-29(40)30(41)23-27/h9,11-13,16,23,26,28,31-33,40-41H,8,10,14-15,17-22,24H2,1-7H3/b16-12+/t26-,28-,31+,32+,33+,36-,37+,38-,39+/m1/s1 |
| SMILES |
CC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](OC(=O)/C=C/c5ccc(O)c(O)c5)CC[C@@]45C[C@@]35CC[C@]12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Poaceae | Phalaris canariensis  | Ref. |
|
|
zoom in
| Organism | Phalaris canariensis |
|---|
| Reference | Chapon, S. et al., Bull. Soc. Chim. Fr., 1952, 456-457 (isol) |
|---|
|
