input word = C00000522

Metabolite InformationStructural formula
Name Isosegoline A
Formula C23H19N3O3
Mw 385.1426415
CAS RN 117694-97-0
C_ID C00000522 ,
InChIKey HSCRWFYMNNKDLC-QICBTZQUNA-N
InChICode InChI=1S/C23H19N3O3/c1-11-23(2)18(21(27)25-22(23)28)14-10-16(29-3)19-17-13(8-9-24-19)12-6-4-5-7-15(12)26(11)20(14)17/h4-11,18H,1-3H3,(H,25,27,28)/t11-,18-,23-/m0/s1
SMILES c1(cc2c3c4c1nccc4c1c(n3[C@H]([C@]3([C@@H]2C(=O)NC3=O)C)C)cccc1)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
AnimaliaClavelinidaeEudistoma sp. Ref.
zoom in