| Name |
Quadrangularic acid J
(+)-Quadrangularic acid J |
| Formula |
C31H50O5 |
| Mw |
502.36582471 |
| CAS RN |
254757-94-3 |
| C_ID |
C00046872
, 
|
| InChIKey |
CJMHKPWFQAETJT-FDYIRBNRNA-N |
| InChICode |
InChI=1S/C31H50O5/c1-19(9-8-13-26(2,3)36-7)20-12-14-28(5)21-10-11-22-29(6,25(34)35)23(32)17-24(33)31(22)18-30(21,31)16-15-27(20,28)4/h8,13,19-24,32-33H,9-12,14-18H2,1-7H3,(H,34,35)/b13-8+/t19-,20-,21+,22+,23+,24+,27-,28+,29+,30+,31-/m1/s1 |
| SMILES |
COC(C)(C)/C=C/C[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(C(=O)O)[C@@H](O)C[C@H](O)[C@@]45C[C@@]35CC[C@]12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Combretaceae | Combretum quadrangulare  | Ref. |
|
|
zoom in
|
