input word = C00000521

Metabolite InformationStructural formula
Name Segoline B
Formula C23H19N3O3
Mw 385.1426415
CAS RN 122795-54-4
C_ID C00000521 ,
InChIKey ZOOFKNHZEAAAAK-KFXOKYLSNA-N
InChICode InChI=1S/C23H19N3O3/c1-11-17-14-10-16(29-3)19-18-13(8-9-24-19)12-6-4-5-7-15(12)26(20(14)18)23(11,2)22(28)25-21(17)27/h4-11,17H,1-3H3,(H,25,27,28)/t11-,17+,23+/m0/s1
SMILES COc1cc2c3c4c(ccnc14)-c1ccccc1N3C1(C)C(=O)NC(=O)[C@@H]2[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
AnimaliaClavelinidaeEudistoma sp. Ref.
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