| Name |
N-Demethylmitiphylline |
| Formula |
C30H47NO6 |
| Mw |
517.34033824 |
| CAS RN |
36948-64-8 |
| C_ID |
C00025524
, 
|
| InChIKey |
QLCJXHUAXDJDFZ-YEEZMSRANA-N |
| InChICode |
InChI=1S/C30H47NO6/c1-17-27(31)24(34-4)15-26(36-17)37-20-7-10-28(2)19(14-20)5-6-23-22(28)8-11-29(3)21(9-12-30(23,29)33)18-13-25(32)35-16-18/h13,17,19-24,26-27,33H,5-12,14-16,31H2,1-4H3/t17-,19-,20+,21-,22+,23-,24+,26-,27-,28+,29-,30+/m1/s1 |
| SMILES |
[C@]12([C@@H]3CC[C@@H]4C[C@H](CC[C@@]4([C@H]3CC[C@@]1([C@H](CC2)C1=CC(=O)OC1)C)C)O[C@@H]1C[C@@H]([C@@H]([C@H](O1)C)N)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Arg Cholesterol |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Holarrhena mitis | Ref. |
|
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