| Name |
Perhentinine
(-)-Perhentinine
|
| Formula |
C43H52N4O5 |
| Mw |
704.3937708 |
| CAS RN |
714915-09-0 |
| C_ID |
C00026674
, 
|
| InChIKey |
IVWWZRUIGFCZGZ-GDJITHMRNA-N |
| InChICode |
InChI=1S/C43H52N4O5/c1-22(49)26(27-14-39-42-30(16-36(44(39)3)32(27)19-48)25-10-8-9-11-35(25)46(42)5)12-24-13-29-31-17-37-34-21-52-20-33(23(2)50)28(34)15-40(45(37)4)43(31)47(6)38(29)18-41(24)51-7/h8-11,13,18,20,26-28,32,34,36-37,39-40,48H,12,14-17,19,21H2,1-7H3/t26-,27+,28+,32-,34-,36+,37+,39+,40+/m1/s1 |
| SMILES |
COc1cc2c(cc1CC(C(C)=O)[C@@H]1C[C@H]3c4c(c5ccccc5n4C)C[C@@H]([C@@H]1CO)N3C)c1c(n2C)[C@@H]2C[C@H]3C(C(C)=O)=COC[C@H]3[C@H](C1)N2C |
| Start Substs in Alk. Biosynthesis (Prediction) |
Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Alstonia macrophylla  | Ref. |
|
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