| Name |
Callichiline |
| Formula |
C42H48N4O5 |
| Mw |
688.36247067 |
| CAS RN |
31230-09-8 |
| C_ID |
C00001698
, 
|
| InChIKey |
AXSFWIGDSYMZQJ-SDHMJHOMNA-N |
| InChICode |
InChI=1S/C42H48N4O5/c1-48-29-9-5-7-27-31(29)44-42-24-20-37-13-18-50-30(37)10-15-45(35(37)42)17-12-41(27,42)39(21-24)23-46-16-11-40-26-6-3-4-8-28(26)43-32(40)25(33(47)49-2)22-38(34(40)46)14-19-51-36(38)39/h3-9,24,30,34-36,43-44H,10-23H2,1-2H3/t24-,30-,34-,35-,36+,37+,38-,39+,40-,41-,42-/m0/s1 |
| SMILES |
C12=C(C[C@@]34[C@H]5[C@]1(c1c(N2)cccc1)CCN5C[C@]1([C@@H]3OCC4)[C@]23[C@]4([C@H]5N(CC2)CC[C@H]2[C@]5(C[C@H]4C1)CCO2)Nc1c(cccc31)OC)C(=O)OC |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Callichilia barteria | Ref. |
| Plantae | Apocynaceae | Conopharyngia spp. | Ref. |
| Plantae | Apocynaceae | Voacanga spp. | Ref. |
| Plantae | Callitrichaceae | Callitriche deflexa var. subsessilis | Ref. |
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